SCHEMBL7320112

SCHEMBL7320112

Cc1ccc(S(=O)(=O)NCC(CC(=O)O)NC(=O)CCCCc2ccc(C(=N)N)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 11/20 0.61
ITGA2B P08514 11/20 0.61
PLAU P00749 3/20 0.49
HPN P05981 3/20 0.49
F2 P00734 2/20 0.45
TMPRSS6 Q8IU80 2/20 0.45
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 2/20 0.43

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
SCHEMBL7318568 0.90 ITGB3 (0.58) ITGB3ITGA2BF2TMPRSS6ALDH1A1
SCHEMBL7351137 0.87 ITGB3 (0.63) ITGB3ITGA2BPLAUHPN
SCHEMBL7320119 0.85 RAB9A (0.43) ITGB3ITGA2BRAB9AALDH1A1
SCHEMBL7389600 0.80 ITGB3 (0.76) ITGB3ITGA2B
SCHEMBL7323474 0.80 F10 (0.47) ITGB3ITGA2BPLAUHPNF2
SCHEMBL7357410 0.79 ITGB3 (0.68) ITGB3ITGA2B
SCHEMBL7378671 0.78 ITGB3 (0.76) ITGB3ITGA2B
SCHEMBL7348953 0.78 ITGB3 (0.73) ITGB3ITGA2B
SCHEMBL7353684 0.78 ITGB3 (0.63) ITGB3ITGA2BF2TMPRSS6
SCHEMBL7352327 0.78 ITGB3 (0.60) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5264457-A Phenyl amidines sulfonamides useful as platelet aggregation inhibitors G. D. SEARLE & CO. (US) 1993-11-23 US claimed
WO-1993016038-A1 PHENYL AMIDINES SULFONAMIDES USEFUL AS PLATELET AGGREGATION INHIBITORS G. D. SEARLE & CO. (US) 1993-08-19 WO claimed
US-5264457-A Phenyl amidines sulfonamides useful as platelet aggregation inhibitors G. D. SEARLE & CO. (US) 1993-11-23 US disclosed
WO-1993016038-A1 PHENYL AMIDINES SULFONAMIDES USEFUL AS PLATELET AGGREGATION INHIBITORS G. D. SEARLE & CO. (US) 1993-08-19 WO disclosed