IP-GeoScape is designed for the way medicinal chemists think and work, facilitating more efficient and effective new molecule discovery. The Landscape tab reveals areas not currently being explored through analysis of, and substructure searching within, the occupied and unoccupied IP space, whilst also showing how molecular IP associated with a target has developed over time, and where competitors are currently active.
The MedChem tab provides a view intended to be specifically useful for molecular design. It provides a simplified, tiled representation of the molecular IP landscape arranged by structural similarity. Each tile, when selected, gives a simple, but powerful, representation of the contents of the cluster by displaying an image of the most representative structure from the cluster with the most common substructure within the cluster highlighted. This tiled view clearly reveals the unoccupied space which are ripe for new molecules, and by selecting the tiles surrounding such spaces, users can see how the chemotypes on opposite sides of the unoccupied space can be merged to create new compounds.
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