SCHEMBL7673633

SCHEMBL7673633

CN1Cc2cc(C(=O)N(CCO)c3nc4ccccc4[nH]3)ccc2NC(CC(=O)O)C1=O

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.72
ITGAV P06756 20/20 0.72
ITGA2B P08514 6/20 0.71

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
SCHEMBL8325096 0.84 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL8327554 0.83 ITGB3 (0.85) ITGB3ITGAVITGA2B
SCHEMBL6946521 0.83 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL245523 0.83 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL31321063 0.83 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL7918275 0.82 ITGB3 (0.92) ITGB3ITGAVITGA2B
SCHEMBL7077079 0.81 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL6944353 0.81 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL7329758 0.80 ITGB3 (1.00) ITGB3ITGAVITGA2B
SCHEMBL7502474 0.80 ITGB3 (0.69) ITGB3ITGAVITGA2B

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
US-6495545-B1 ANTIOSTEOPOROTIC, ANTIRESTENOTIC, ANTICARCINOGENIC AND ANTIATHEROSCLEROTIC ACTIVITY BAYER AKTIENGESELLSCHAFT (DE) 2002-12-17 US disclosed