SCHEMBL6593363

SCHEMBL6593363

CCOc1cc2c(cc1S(=O)(=O)NC(=S)NC)CC(NC(=O)c1cc(Cl)ccc1OC)CO2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 2/20 0.54
ABCC8 Q09428 2/20 0.54
KCNJ11 Q14654 2/20 0.54
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA12 O43570 1/20 0.46
CA7 P43166 1/20 0.46
CA14 Q9ULX7 1/20 0.46
MAPT P10636 2/20 0.44
POLB P06746 1/20 0.44
NLRP3 Q96P20 2/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
ABCC3 O15438 1/20 0.39
ABCC4 O15439 1/20 0.39
ABCB11 O95342 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL4259500 0.94 ABCC9 (0.56) ABCC9ABCC8KCNJ11CA1CA2
SCHEMBL6591893 0.93 ABCC9 (0.48) ABCC9ABCC8KCNJ11CA1CA2
SCHEMBL6596190 0.89 ABCC9 (0.53) ABCC9ABCC8KCNJ11CA1CA2
SCHEMBL4254830 0.89 ABCC9 (0.50) ABCC9ABCC8KCNJ11CA1CA2
SCHEMBL6589529 0.88 ABCC9 (0.49) ABCC9ABCC8KCNJ11CA1CA2
SCHEMBL4257830 0.86 MAPT (0.51) ABCC9ABCC8KCNJ11CA1CA2
SCHEMBL4267588 0.85 MAPT (0.48) ABCC9ABCC8KCNJ11CA1CA2
SCHEMBL6588735 0.84 MALT1 (0.45) ABCC9ABCC8KCNJ11CA1CA2
SCHEMBL6590364 0.84 MALT1 (0.45) ABCC9ABCC8KCNJ11CA1CA2
SCHEMBL6596251 0.84 MAPT (0.49) ABCC9ABCC8KCNJ11CA1CA2

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-0842927-B1 3-Amido-chromanylsulfonyl(thio)ureas, process for their preparation, their use and medicaments containing them AVENTIS PHARMA GMBH (DE) 2004-02-25 EP disclosed
US-5849755-A 3-amidochromanylsulfonyl(thio)ureas, processes for their preparation, their use, and pharmaceutical preparations comprising them HOECHST AKTIENGESELLSCHAFT (DE) 1998-12-15 US disclosed
EP-0842927-A1 3-Amido-chromanylsulfonyl(thio)ureas, process for their preparation, their use and medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1998-05-20 EP disclosed