SCHEMBL7387828

SCHEMBL7387828

C=CCC(CC(=O)O)NC(=O)NCCCCc1ccc(C=NN)cc1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 10/20 0.37
ITGB3 P05106 3/20 0.37
ITGA2B P08514 3/20 0.37
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL7383875 0.88 CYP4Z1 (0.39) EPHX2ALDH1A1KMT2A
SCHEMBL7384441 0.83 EPHX2 (0.49) EPHX2ITGB3ITGA2BALDH1A1HPGD
SCHEMBL7387824 0.82 ITGB3 (0.56) ITGB3ITGA2B
SCHEMBL7385683 0.80 EPHX2 (0.54) EPHX2ITGB3ITGA2BALDH1A1HPGD
SCHEMBL7385812 0.78 S1PR1 (0.49) EPHX2ITGB3ITGA2BKMT2A
SCHEMBL8995559 0.76 KMT2A (0.44) ALDH1A1HPGDKMT2A
SCHEMBL7386330 0.75 EPHX2 (0.43) EPHX2ITGB3ITGA2B
SCHEMBL7378676 0.75 ITGB3 (0.49) ITGB3ITGA2BALDH1A1HPGDKMT2A
SCHEMBL7382281 0.74 ITGB3 (0.47) ITGB3ITGA2BALDH1A1
SCHEMBL7389607 0.74 ITGB3 (0.50) ITGB3ITGA2BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5344837-A Platelet aggregation inhibitors G.D. SEARLE & CO. (US) 1994-09-06 US disclosed
WO-1994001396-A1 PHENYL AMIDINE UREA DERIVATIVES AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1994-01-20 WO disclosed
US-5272162-A Platelet aggregation inhibitors G. D. SEARLE & CO. (US) 1993-12-21 US disclosed