SCHEMBL7387994

SCHEMBL7387994

CCOC(=O)CC(NC(=O)C(C)(O)NC(=O)Nc1ccc(C(=N)N)cc1)c1cccnc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 8/20 0.53
ITGA2B P08514 8/20 0.53
F2 P00734 7/20 0.41
KMT2A Q03164 1/20 0.41
F10 P00742 5/20 0.39
F7 P08709 5/20 0.39
PRSS1 P07477 2/20 0.39
PRSS2 P07478 1/20 0.39
F3 P13726 1/20 0.39
PRSS3 P35030 1/20 0.39
ROCK2 O75116 1/20 0.38
NAMPT P43490 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
SCHEMBL7388004 1.00 ITGB3 (0.53) ITGB3ITGA2BF2KMT2AF10
SCHEMBL7387014 0.93 ITGB3 (0.54) ITGB3ITGA2BF2KMT2AF10
SCHEMBL7387467 0.89 ITGB3 (0.67) ITGB3ITGA2BF2F7
SCHEMBL7387474 0.89 ITGB3 (0.67) ITGB3ITGA2BF2F7
SCHEMBL7388209 0.86 ITGB3 (0.59) ITGB3ITGA2BF2KMT2AF10
SCHEMBL7387186 0.84 ITGB3 (0.55) ITGB3ITGA2BF2KMT2AF10
SCHEMBL7387179 0.84 ITGB3 (0.55) ITGB3ITGA2BF2KMT2AF10
SCHEMBL7387361 0.84 ITGB3 (0.60) ITGB3ITGA2BF2F10F7
SCHEMBL9394443 0.84 ITGB3 (0.60) ITGB3ITGA2BF2F10F7
SCHEMBL7389396 0.83 ITGB3 (0.64) ITGB3ITGA2BF2KMT2AF7

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-5624956-A Urea derivatives useful as platelet aggregation inhibitors THE MONSANTO COMPANY (US) 1997-04-29 US disclosed
WO-1994017041-A1 AMIDINOPHENYL SUBSTITUTED UREA, THIOUREA OR GUANIDINO DERIVATIVES USEFUL AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1994-08-04 WO disclosed
US-5314902-A Thioureas and guanidine compounds, anticoagulants MONSANTO COMPANY (US) 1994-05-24 US disclosed