SCHEMBL7419726

SCHEMBL7419726

C=CC(CC(=O)O)NC(=O)C[C@@H]1CCN(c2ccc(C(=N)N)cc2)C1=O

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.54
ITGA2B P08514 20/20 0.54

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
SCHEMBL7418515 1.00 ITGB3 (0.54) ITGB3ITGA2B
SCHEMBL7419733 1.00 ITGB3 (0.54) ITGB3ITGA2B
SCHEMBL7416268 0.94 ITGB3 (0.52) ITGB3ITGA2B
SCHEMBL7416280 0.94 ITGB3 (0.52) ITGB3ITGA2B
SCHEMBL7416273 0.94 ITGB3 (0.52) ITGB3ITGA2B
SCHEMBL8118529 0.91 ITGB3 (0.48) ITGB3ITGA2B
SCHEMBL7419180 0.87 ITGB3 (0.52) ITGB3ITGA2B
SCHEMBL7413725 0.87 ITGB3 (0.52) ITGB3ITGA2B
SCHEMBL7419176 0.87 ITGB3 (0.52) ITGB3ITGA2B
SCHEMBL7416061 0.85 ITGB3 (0.56) ITGB3ITGA2B

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0691953-B1 1-AMIDINOPHENYL-PYRROLIDONES/ PIPERIDINONES AS PLATELET AGGREGATION INHIBITORS SEARLE & CO (US) 2000-08-02 EP claimed
JP-3034046-B2 2000-04-17 JP claimed
EP-0691953-A1 1-AMIDINOPHENYL-PYRROLIDONES PIPERIDINONES AZETINONES AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1996-01-17 EP claimed
WO-1994022820-A1 1-AMIDINOPHENYL-PYRROLIDONES PIPERIDINONES AZETINONES AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1994-10-13 WO claimed
EP-0691953-B1 1-AMIDINOPHENYL-PYRROLIDONES/ PIPERIDINONES AS PLATELET AGGREGATION INHIBITORS SEARLE & CO (US) 2000-08-02 EP disclosed