SCHEMBL6588694

SCHEMBL6588694

COc1ccc(Cl)cc1C(=O)NC1COc2cc(C)c(S(N)(=O)=O)cc2C1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
CA12 O43570 1/20 0.60
CA7 P43166 1/20 0.60
CA14 Q9ULX7 1/20 0.60
MAPT P10636 3/20 0.51
POLB P06746 2/20 0.51
NLRP3 Q96P20 1/20 0.44
NPC1 O15118 2/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
RAB9A P51151 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MALT1 Q9UDY8 5/20 0.44
LMNA P02545 2/20 0.43
MTNR1A P48039 1/20 0.42

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
SCHEMBL6594756 0.93 CA1 (0.62) CA1CA2CA12CA7CA14
SCHEMBL6596190 0.86 ABCC9 (0.53) CA1CA2CA12CA7CA14
SCHEMBL6593867 0.83 CA1 (0.57) CA1CA2CA12CA7CA14
SCHEMBL6590513 0.82 MALT1 (0.49) CA1CA2CA12CA7CA14
SCHEMBL4257830 0.82 MAPT (0.51) CA1CA2CA12CA7CA14
SCHEMBL4259500 0.80 ABCC9 (0.56) CA1CA2CA12CA7CA14
SCHEMBL6590576 0.80 MAPT (0.61) CA1CA2CA12CA7CA14
SCHEMBL6596251 0.80 MAPT (0.49) CA1CA2CA12CA7CA14
SCHEMBL6591042 0.80 MAPT (0.49) CA1CA2CA12CA7CA14
SCHEMBL4267588 0.79 MAPT (0.48) CA1CA2CA12CA7CA14

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 5 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
CN-1101815-C 3 -amidochromanylsulfonyl (thio) ureas, processes for their preparation, their use, and pharmaceutical preparations comprising them HOECHST AG (DE) 2003-02-19 CN 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
CN-1182741-A 3 -amidochromanylsulfonyl (thio) ureas, processes for their preparation, their use, and pharmaceutical preparations comprising them HOECHST AG (DE) 1998-05-27 CN 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