SCHEMBL7023489

SCHEMBL7023489

COc1ccc(Cl)cc1C(=O)NCCc1ccc(-c2ccc(S(C)(=O)=O)cc2)c(S(=O)(=O)N=CN(C)C)c1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 3/20 0.56
ABCC9 O60706 1/20 0.52
ABCC8 Q09428 1/20 0.52
KCNJ11 Q14654 1/20 0.52
DNMT3A Q9Y6K1 1/20 0.51

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
SCHEMBL7023486 1.00 NLRP3 (0.56) NLRP3ABCC9ABCC8KCNJ11DNMT3A
SCHEMBL7357111 0.94 ABCC9 (0.56) NLRP3ABCC9ABCC8KCNJ11DNMT3A
SCHEMBL7357107 0.94 ABCC9 (0.56) NLRP3ABCC9ABCC8KCNJ11DNMT3A
SCHEMBL7023779 0.92 ABCC9 (0.53) NLRP3ABCC9ABCC8KCNJ11DNMT3A
SCHEMBL7023780 0.92 ABCC9 (0.53) NLRP3ABCC9ABCC8KCNJ11DNMT3A
SCHEMBL7024403 0.91 ABCC9 (0.53) NLRP3ABCC9ABCC8KCNJ11DNMT3A
SCHEMBL7024396 0.91 ABCC9 (0.53) NLRP3ABCC9ABCC8KCNJ11DNMT3A
SCHEMBL7022279 0.91 NLRP3 (0.55) NLRP3ABCC9ABCC8KCNJ11DNMT3A
SCHEMBL7022283 0.91 NLRP3 (0.55) NLRP3ABCC9ABCC8KCNJ11DNMT3A
SCHEMBL7017020 0.90 ABCC9 (0.51) NLRP3ABCC9ABCC8KCNJ11DNMT3A

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
EP-1100775-B1 2,5-SUBSTITUTED BENZOLSULFONYLUREAS AND THIOUREAS, METHODS FOR THE PRODUCTION THEREOF, USE THEREOF AND PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME AVENTIS PHARMA GMBH (DE) 2003-12-17 EP disclosed
US-6410573-B1 CARDIOVASCULAR DISEASES; POTASSIUM CHANNEL MODULATOR AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-06-25 US disclosed
EP-1100775-A2 2,5-SUBSTITUTED BENZOLSULFONYLUREAS AND THIOUREAS, METHODS FOR THE PRODUCTION THEREOF, USE THEREOF AND PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME Hoechst Marion Roussel Deutschland GmbH (DE) 2001-05-23 EP disclosed
WO-2000003978-A2 2,5-SUBSTITUTED BENZOLSULFONYLUREAS AND THIOUREAS, METHODS FOR THE PRODUCTION THEREOF, USE THEREOF AND PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-01-27 WO disclosed