SCHEMBL7666176

SCHEMBL7666176

CN1Cc2cc(-c3nnc(-c4nc5ccccc5[nH]4)o3)ccc2NC(CC(=O)O)C1=O

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.61
ITGAV P06756 20/20 0.61
ITGA2B P08514 6/20 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
SCHEMBL7668062 0.91 ITGB3 (0.53) ITGB3ITGAVITGA2B
SCHEMBL7672549 0.89 ITGB3 (0.64) ITGB3ITGAVITGA2B
SCHEMBL7668523 0.88 ITGB3 (0.63) ITGB3ITGAVITGA2B
SCHEMBL7663556 0.88 ITGB3 (0.63) ITGB3ITGAVITGA2B
SCHEMBL8328924 0.87 ITGB3 (0.65) ITGB3ITGAVITGA2B
SCHEMBL7673640 0.85 ITGB3 (0.61) ITGB3ITGAVITGA2B
SCHEMBL7666099 0.79 ITGB3 (0.59) ITGB3ITGAVITGA2B
SCHEMBL7668601 0.78 ITGB3 (0.50) ITGB3ITGAVITGA2B
SCHEMBL7664091 0.77 ITGB3 (0.53) ITGB3ITGAVITGA2B
SCHEMBL6947553 0.76 ITGB3 (0.77) 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 2 patents. 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
US-6339083-B1 FOR THERAPY OF OSTEOPOROSIS, RESTENOSIS, CARCINOSES AND/OR ARTERIOSCLEROSIS BAYER AKTIENGESELLSCHAFT (DE) 2002-01-15 US disclosed