SCHEMBL3765246

SCHEMBL3765246

CNC(=S)NS(=O)(=O)c1cc(CCNC(=O)c2ccc(Cl)cc2OC)ccc1OC

nearest known ligand 0.88

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 1/20 0.88
ABCC8 Q09428 1/20 0.88
KCNJ11 Q14654 1/20 0.88
NLRP3 Q96P20 3/20 0.56
DNMT3A Q9Y6K1 1/20 0.52
HDAC1 Q13547 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
GAA P10253 1/20 0.48

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
Clamikalant SCHEMBL29387853 0.94 ABCC9 (1.00) ABCC9ABCC8KCNJ11NLRP3DNMT3A
Clamikalant SCHEMBL726268 0.94 ABCC9 (1.00) ABCC9ABCC8KCNJ11NLRP3DNMT3A
Clamikalant SCHEMBL4254889 0.93 ABCC9 (0.98) ABCC9ABCC8KCNJ11NLRP3DNMT3A
Clamikalant SCHEMBL4254888 0.93 ABCC9 (0.98) ABCC9ABCC8KCNJ11NLRP3DNMT3A
SCHEMBL726272 0.87 ABCC9 (0.87) ABCC9ABCC8KCNJ11NLRP3DNMT3A
SCHEMBL6567784 0.86 ABCC9 (0.85) ABCC9ABCC8KCNJ11NLRP3DNMT3A
SCHEMBL6567790 0.86 ABCC9 (0.85) ABCC9ABCC8KCNJ11NLRP3DNMT3A
SCHEMBL7016981 0.86 ABCC9 (0.85) ABCC9ABCC8KCNJ11NLRP3DNMT3A
SCHEMBL7018854 0.84 ABCC9 (0.82) ABCC9ABCC8KCNJ11NLRP3DNMT3A
SCHEMBL4261594 0.84 ABCC9 (0.82) ABCC9ABCC8KCNJ11NLRP3DNMT3A

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-20100316575-A1 MODULATING BODY WEIGHT MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2010-12-16 US claimed
WO-2009099820-A2 MODULATING BODY WEIGHT MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2009-08-13 WO claimed
US-20100316575-A1 MODULATING BODY WEIGHT MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2010-12-16 US disclosed
WO-2009099820-A2 MODULATING BODY WEIGHT MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2009-08-13 WO disclosed