SCHEMBL1011939

SCHEMBL1011939

Nc1cc(NC(=O)C(Br)CBr)ccc1S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
GRIK1 P39086 1/20 0.36
GRIK2 Q13002 1/20 0.36
CASR P41180 1/20 0.36
RAPGEF4 Q8WZA2 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
ENPP2 Q13822 2/20 0.35
AR P10275 1/20 0.34
CA1 P00915 6/20 0.34
CA2 P00918 6/20 0.34
CA7 P43166 5/20 0.34
CA14 Q9ULX7 5/20 0.34
NT5E P21589 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
TERT O14746 1/20 0.33

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
SCHEMBL30967742 1.00 NPC1 (0.37) NPC1RAB9AALDH1A1KMT2AGRIK1
SCHEMBL7731859 0.90 CTDSP1 (0.45) NPC1RAB9AALDH1A1KMT2AGRIK1
SCHEMBL30967743 0.86 GRIK1 (0.43) ALDH1A1KMT2AGRIK1GRIK2CASR
SCHEMBL30967744 0.86 GRIK1 (0.43) ALDH1A1KMT2AGRIK1GRIK2CASR
SCHEMBL12829324 0.85 ALDH1A1 (0.47) ALDH1A1KMT2AGRIK1GRIK2CASR
SCHEMBL11204872 0.83 CA2 (0.38) NPC1RAB9AALDH1A1CASRCA1
SCHEMBL11151982 0.83 ACP1 (0.35) ALDH1A1KMT2ACASRRAPGEF4CTDSP1
SCHEMBL12830031 0.82 CNR2 (0.42) ALDH1A1KMT2AENPP2CA1CA2
SCHEMBL7766744 0.82 TDP1 (0.41) NPC1RAB9AALDH1A1KMT2ACASR
SCHEMBL10797661 0.81 CA1 (0.53) NPC1RAB9AALDH1A1KMT2AAR

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1669415-B2 Dye mixture and the use thereof EVERLIGHT USA INC (US) 2017-03-22 EP disclosed
EP-1247841-B1 Reactive dyes, process for their preparation and the use thereof HUNTSMAN ADV MAT SWITZERLAND (CH) 2012-09-26 EP disclosed
EP-1669415-B1 Dye mixture and the use thereof EVERLIGHT USA INC (US) 2011-01-05 EP disclosed
US-7387647-B2 Dye composition and the use thereof EVERLIGHT USA, INC. (US) 2008-06-17 US disclosed
EP-1669415-A1 Dye mixture and the use thereof Everlight USA, Inc. (US) 2006-06-14 EP disclosed
US-20060112504-A1 Dye composition and the use thereof EVERLIGHT USA, INC. (US) 2006-06-01 US disclosed
EP-0969051-B1 Mixtures of reactive dyes and their utilisation CIBA SC HOLDING AG (CH) 2002-11-27 EP disclosed
US-6407220-B1 FOR DYEING AND PRINTING OF MATERIALS CONTAINING CELLULOSE FIBERS; HIGH FIXATION AND GOOD BUILD-UP EVERLIGHT USA, INC. 2002-06-18 US disclosed
CN-1080289-C Fibre-reactive dyes, their preparation and use CIBA SC HOLDING AG (CH) 2002-03-06 CN disclosed
EP-0699719-B1 Azodyes, process for their preparation and the use thereof CIBA SC HOLDING AG (CH) 2002-01-02 EP disclosed
EP-0114032-A2 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1984-07-25 EP disclosed
EP-0112797-A1 Process for dyeing or printing cellulose-containing fibrous material with reactive dyes CIBA-GEIGY AG (CH) 1984-07-04 EP disclosed
US-4382890-A BRIGHT YELLOW; COLORFASTNESS; PRINTING/DYEING CIBA-GEIGY CORPORATION (US) 1983-05-10 US disclosed
US-4283331-A FIBER-REACTIVE DYES CIBA-GEIGY CORPORATION (US) 1981-08-11 US disclosed
US-4248773-A FOR RED TEXTILES, LEATHERS CIBA-GEIGY CORPORATION (US) 1981-02-03 US disclosed
US-4211698-A Disazo dyes containing an acetoacetanilide middle component CIBA-GEIGY CORPORATION (US) 1980-07-08 US disclosed
US-4210582-A FIBER-REACTIVE YELLOW DYES FOR WOOL CIBA-GEIGY CORPORATION (US) 1980-07-01 US disclosed
US-4033943-A Fiber reactive water soluble 2,4,6-triamino, 3-cyano pyridine-(5) azo dyestuffs CIBA-GEIGY CORPORATION (US) 1977-07-05 US disclosed
US-4001205-A WATER-SOLUBLE, FIBER-REACTIVE PHENYLAZODIHYDROXY, METHYL, CYANOPYRIDINE DYESTUFFS CIBA-GEIGY AG (CH) 1977-01-04 US disclosed
US-3956263-A 4-Methyl-2,6-dihydroxy-3-cyanopyridine containing dyestuffs CIBA-GEIGY AG (CH) 1976-05-11 US disclosed