SCHEMBL8557864

SCHEMBL8557864

N=C(N)c1ccc(N2CCC(CC(=O)O)C2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 18/20 0.49
ITGA2B P08514 18/20 0.49
ALOX15 P16050 1/20 0.46
F10 P00742 1/20 0.44

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
SCHEMBL27462928 0.90 ITGB3 (0.47) ITGB3ITGA2BALOX15F10
SCHEMBL7419652 0.85 ITGB3 (0.53) ITGB3ITGA2B
SCHEMBL9029210 0.83 ITGB3 (0.53) ITGB3ITGA2B
SCHEMBL7416061 0.83 ITGB3 (0.56) ITGB3ITGA2B
SCHEMBL9028484 0.83 ITGB3 (0.47) ITGB3ITGA2BF10
SCHEMBL9028236 0.82 ITGB3 (0.44) ITGB3ITGA2B
SCHEMBL9028226 0.82 ITGB3 (0.44) ITGB3ITGA2B
SCHEMBL8427476 0.82 HTT (0.47)
SCHEMBL9029205 0.81 ITGB3 (0.46) ITGB3ITGA2BF10
SCHEMBL7419733 0.81 ITGB3 (0.54) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0825994-A1 AMIDINE DERIVATIVES USEFUL AS ANTI-PLATELET AGGREGATION INHIBITORS AND VASODILATORS G.D. SEARLE & CO. (US) 1998-03-04 EP disclosed
US-5674894-A Amidine derivatives useful as platelet aggregation inhibitors and vasodilators G.D. SEARLE & CO. (US) 1997-10-07 US disclosed
WO-1996036639-A1 AMIDINE DERIVATIVES USEFUL AS ANTI-PLATELET AGGREGATION INHIBITORS AND VASODILATORS G.D. SEARLE & CO. (US) 1996-11-21 WO disclosed