SCHEMBL9464499

SCHEMBL9464499

Nc1ccccc1S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.71
GAA P10253 1/20 0.63
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
ALDH1A1 P00352 1/20 0.56
CYP3A4 P08684 1/20 0.56
MAPK1 P28482 1/20 0.56
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA4 P22748 2/20 0.50
CA6 P23280 2/20 0.50
CA5A P35218 2/20 0.50
CA7 P43166 2/20 0.50
CA9 Q16790 2/20 0.50
CA14 Q9ULX7 2/20 0.50
CA5B Q9Y2D0 2/20 0.50
CYP2C9 P11712 1/20 0.50
CNR2 P34972 1/20 0.49
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL10869745 0.86 ALDH1A1 (0.68) HTR6MEN1KMT2AALDH1A1CYP3A4
SCHEMBL34558 0.84 HTR6 (0.77) HTR6GAAMEN1KMT2AALDH1A1
SCHEMBL395274 0.84 HTR6 (1.00) HTR6GAAKMT2AALDH1A1CA12
SCHEMBL30751995 0.84 HTR6 (1.00) HTR6GAAKMT2AALDH1A1CA12
SCHEMBL2004711 0.81 HTR6 (0.71) HTR6GAAMEN1KMT2AALDH1A1
SCHEMBL5261746 0.81 MEN1 (0.57) HTR6MEN1KMT2AALDH1A1CYP3A4
SCHEMBL20723646 0.81 HTR6 (0.71) HTR6GAAALDH1A1CA12CA1
SCHEMBL11211365 0.81 MEN1 (0.57) HTR6MEN1KMT2AALDH1A1CYP3A4
SCHEMBL2947083 0.80 ALDH1A1 (0.60) MEN1KMT2AALDH1A1CYP3A4MAPK1
SCHEMBL2034446 0.80 HSD11B1 (0.68) MEN1KMT2AALDH1A1CYP3A4MAPK1

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
US-5204453-A Process for the preparation of 1:2 metal complex azo compounds by carrying out diazotization and coupling in the presence of a metal donor CIBA-GEIGY CORPORATION (US) 1993-04-20 US disclosed
US-4997921-A Substituted phenylazosulfoindole dyes CIBA-GEIGY CORPORATION (US) 1991-03-05 US disclosed
US-4954563-A Polyamide dye CIBA-GEIGY CORPORATION (US) 1990-09-04 US disclosed