SCHEMBL9464302

SCHEMBL9464302

Nc1ccc(NS(=O)(=O)Nc2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.66
KEAP1 Q14145 3/20 0.66
ALDH1A1 P00352 3/20 0.58
MAPT P10636 3/20 0.58
HTT P42858 2/20 0.58
CYP1A2 P05177 2/20 0.58
CYP3A4 P08684 2/20 0.58
CYP2C19 P33261 2/20 0.58
CYP2C9 P11712 1/20 0.58
ALOX12 P18054 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
MEN1 O00255 4/20 0.51
POLB P06746 1/20 0.50
PKM P14618 1/20 0.50
CA9 Q16790 2/20 0.48
RAB9A P51151 1/20 0.48
IL1RN P18510 1/20 0.48
ERAP1 Q9NZ08 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
SCHEMBL28825388 0.91 KEAP1 (0.57) KMT2AKEAP1ALDH1A1MAPTHTT
SCHEMBL23141160 0.89 KEAP1 (0.61) KMT2AKEAP1ALDH1A1MAPTALOX12
SCHEMBL59151 0.86 KEAP1 (0.64) KMT2AKEAP1ALDH1A1MAPTHTT
SCHEMBL9387480 0.83 KEAP1 (0.76) KMT2AKEAP1ALDH1A1MAPTHTT
SCHEMBL9464239 0.80 KEAP1 (0.49) KMT2AKEAP1ALDH1A1MAPTHTT
SCHEMBL9464347 0.80 KEAP1 (0.49) KMT2AKEAP1ALDH1A1MAPTHTT
SCHEMBL3081180 0.79 KEAP1 (1.00) KMT2AKEAP1ALDH1A1MAPTHTT
Sulfabenz SCHEMBL193566 0.79 KMT2A (1.00) KMT2AKEAP1ALDH1A1MAPTHTT
SCHEMBL9464922 0.78 KEAP1 (0.50) KMT2AKEAP1ALDH1A1MAPTHTT
SCHEMBL9464234 0.77 POLB (0.46) KMT2AKEAP1ALDH1A1MAPTHTT

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
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
EP-0241414-B1 PROCESS FOR THE PREPARATION OF 1:2 METAL COMPLEX AZO DYES CIBA-GEIGY AG (CH) 1991-05-08 EP 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
EP-0121495-A1 Monoazo dyestuffs, their preparation and their use CIBA-GEIGY AG (CH) 1984-10-10 EP disclosed