SCHEMBL7422754

SCHEMBL7422754

N=C(N)c1ccc(N2CCCC(CC(=O)NC(CC(=O)O)c3ccco3)C2=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 17/20 0.40
ITGA2B P08514 17/20 0.40
F9 P00740 2/20 0.38
F10 P00742 1/20 0.38

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
SCHEMBL7421592 0.89 ITGB3 (0.46) ITGB3ITGA2BF9F10
SCHEMBL7419407 0.88 ITGB3 (0.52) ITGB3ITGA2BF10
SCHEMBL7412389 0.88 ITGB3 (0.52) ITGB3ITGA2BF10
SCHEMBL8117179 0.85 ITGB3 (0.41) ITGB3ITGA2BF9
SCHEMBL8117174 0.85 ITGB3 (0.41) ITGB3ITGA2BF9
SCHEMBL27352804 0.85 ITGB3 (0.41) ITGB3ITGA2BF9
SCHEMBL7422771 0.85 ITGB3 (0.39) ITGB3ITGA2B
SCHEMBL7423350 0.83 ITGB3 (0.55) ITGB3ITGA2BF9F10
SCHEMBL8117257 0.83 ITGB3 (0.55) ITGB3ITGA2BF9F10
SCHEMBL7414401 0.83 ITGB3 (0.55) ITGB3ITGA2BF9F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1054842-C Platelet aggregation inhibitors SEARLE & CO (US) 2000-07-26 CN claimed
CN-1124957-A 1-amidinophenyl-pyrrolidones piperidinones azetinones as platelet aggregation inhibitors SEARLE & CO (US) 1996-06-19 CN claimed
EP-0691953-B1 1-AMIDINOPHENYL-PYRROLIDONES/ PIPERIDINONES AS PLATELET AGGREGATION INHIBITORS SEARLE & CO (US) 2000-08-02 EP disclosed
CN-1054842-C Platelet aggregation inhibitors SEARLE & CO (US) 2000-07-26 CN disclosed
CN-1124957-A 1-amidinophenyl-pyrrolidones piperidinones azetinones as platelet aggregation inhibitors SEARLE & CO (US) 1996-06-19 CN disclosed
WO-1994022820-A1 1-AMIDINOPHENYL-PYRROLIDONES PIPERIDINONES AZETINONES AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1994-10-13 WO disclosed