SCHEMBL9028819

SCHEMBL9028819

N=C(N)c1ccc(N2CC[C@H](NC(=O)NC=CCCC(=O)O)C2=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 17/20 0.57
ITGA2B P08514 17/20 0.57
FPR2 P25090 3/20 0.41
FPR1 P21462 2/20 0.41

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
SCHEMBL7425949 1.00 ITGB3 (0.57) ITGB3ITGA2BFPR2FPR1
SCHEMBL7420246 0.87 ITGB3 (0.73) ITGB3ITGA2BFPR2FPR1
SCHEMBL27350762 0.87 ITGB3 (0.73) ITGB3ITGA2BFPR2FPR1
SCHEMBL7413110 0.83 ITGB3 (0.75) ITGB3ITGA2BFPR2FPR1
SCHEMBL7075515 0.83 ITGB3 (0.75) ITGB3ITGA2BFPR2FPR1
SCHEMBL7417376 0.83 ITGB3 (0.43) ITGB3ITGA2B
SCHEMBL7417379 0.83 ITGB3 (0.43) ITGB3ITGA2B
Acetic Acid SCHEMBL7418342 0.80 ITGB3 (0.75) ITGB3ITGA2BFPR2FPR1
SCHEMBL7419100 0.79 ITGB3 (0.42) ITGB3ITGA2B
SCHEMBL7419097 0.79 ITGB3 (0.42) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0691953-A1 1-AMIDINOPHENYL-PYRROLIDONES PIPERIDINONES AZETINONES AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1996-01-17 EP claimed
EP-0691953-A1 1-AMIDINOPHENYL-PYRROLIDONES PIPERIDINONES AZETINONES AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1996-01-17 EP disclosed