SCHEMBL6678690

SCHEMBL6678690

NN=Cc1ccc(CNC(=O)c2ccc3c(c2)CC(CC(=O)O)C(=O)N(CCc2cccs2)C3)cc1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 19/20 0.53
ITGA2B P08514 16/20 0.53
ITGAV P06756 5/20 0.37
NAMPT P43490 1/20 0.36

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
SCHEMBL6677682 0.90 ITGB3 (0.54) ITGB3ITGA2BITGAV
SCHEMBL6678683 0.88 ITGB3 (0.57) ITGB3ITGA2BITGAV
SCHEMBL6677727 0.88 ITGB3 (0.57) ITGB3ITGA2BITGAV
SCHEMBL6677738 0.84 ITGB3 (0.62) ITGB3ITGA2BITGAV
SCHEMBL6676580 0.80 ITGB3 (0.48) ITGB3ITGA2BITGAVNAMPT
SCHEMBL7435601 0.79 ITGB3 (0.59) ITGB3ITGA2BITGAVNAMPT
SCHEMBL7435590 0.79 ITGB3 (0.59) ITGB3ITGA2BITGAVNAMPT
SCHEMBL6675234 0.78 ITGB3 (0.48) ITGB3ITGA2BITGAV
SCHEMBL6677677 0.77 ITGB3 (0.70) ITGB3ITGA2BITGAV
SCHEMBL6677664 0.77 ITGB3 (0.70) 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
WO-1995018619-A9 BICYCLIC FIBRINOGEN ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-10-21 WO disclosed
US-6117866-A Bicyclic fibrinogen antagonists SMITHKLINE BEECHAM CORPORATION (US) 2000-09-12 US disclosed