SCHEMBL7597419

SCHEMBL7597419

COC(=O)CC1Nc2ccc(NC(=O)c3ccc(C=NN)cc3)cc2CN(CCc2ccccc2)C1=O

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 18/20 0.60
ITGA2B P08514 15/20 0.60
ITGAV P06756 5/20 0.60

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
SCHEMBL7396982 0.93 ITGB3 (0.70) ITGB3ITGA2BITGAV
SCHEMBL7397922 0.90 ITGB3 (0.56) ITGB3ITGA2BITGAV
SCHEMBL7597411 0.88 ITGB3 (0.78) ITGB3ITGA2BITGAV
SCHEMBL7594819 0.88 ITGB3 (0.78) ITGB3ITGA2BITGAV
SCHEMBL7396683 0.88 ITGB3 (0.55) ITGB3ITGA2BITGAV
SCHEMBL7397690 0.87 ITGB3 (0.77) ITGB3ITGA2BITGAV
SCHEMBL6952593 0.84 ITGB3 (0.77) ITGB3ITGA2BITGAV
SCHEMBL7593450 0.84 ITGB3 (0.75) ITGB3ITGA2BITGAV
Hydrochloric Acid SCHEMBL3042381 0.84 ITGB3 (0.76) ITGB3ITGA2BITGAV
SCHEMBL7396973 0.80 ITGB3 (0.91) 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 2 patents. 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
US-6127359-A Bicyclic fibrinogen antagonists SMITHKLINE BEECHAM CORPORATION (US) 2000-10-03 US disclosed