SCHEMBL7602815

SCHEMBL7602815

CN(C(=O)c1ccc2c(c1)N[C@@H](CC(=O)O)C(=O)N(CCc1ccccc1)C2)c1ccc(C(N)=NC(=O)OCc2ccccc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.75
ITGA2B P08514 18/20 0.75
ITGAV P06756 4/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6949745 1.00 ITGB3 (0.75) ITGB3ITGA2BITGAV
SCHEMBL7443001 0.96 ITGB3 (0.68) ITGB3ITGA2BITGAV
SCHEMBL7666755 0.91 ITGB3 (0.60) ITGB3ITGA2BITGAV
SCHEMBL7396910 0.87 ITGB3 (0.74) ITGB3ITGA2BITGAV
SCHEMBL6675228 0.86 ITGB3 (0.75) ITGB3ITGA2B
SCHEMBL6953357 0.86 ITGB3 (0.55) ITGB3ITGA2BITGAV
SCHEMBL6953188 0.86 ITGB3 (1.00) ITGB3ITGA2BITGAV
SCHEMBL7433061 0.86 ITGB3 (0.74) ITGB3ITGA2BITGAV
SCHEMBL7437134 0.85 ITGB3 (0.84) ITGB3ITGA2BITGAV
SCHEMBL7504649 0.84 ITGB3 (0.51) ITGB3ITGA2BITGAV

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0593603-B1 BICYCLIC FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2002-11-20 EP disclosed