SCHEMBL8967941

SCHEMBL8967941

Nc1c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(O)c2c1C(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.54
NT5E P21589 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 3/20 0.44
MAPK1 P28482 1/20 0.44
DNASE1L3 Q13609 1/20 0.44
PRMT1 Q99873 1/20 0.43
ALDH1A1 P00352 4/20 0.42
HSD17B10 Q99714 3/20 0.42
CYP2C19 P33261 2/20 0.42
HIF1A Q16665 1/20 0.42
CASP6 P55212 4/20 0.41
NSD2 O96028 2/20 0.41
DUSP3 P51452 2/20 0.41
PTPN5 P54829 2/20 0.41
PTPN11 Q06124 2/20 0.41
CASP7 P55210 1/20 0.41
ENPP2 Q13822 3/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL9098343 0.86 CA2 (0.43) APEX1NT5ECYP1A2CYP2C19LMNA
SCHEMBL11673456 0.82 NT5E (0.55) APEX1NT5ECYP1A2CYP2C9MAPK1
SCHEMBL9698818 0.81 APEX1 (0.44) APEX1NT5ECYP1A2CYP2C9MAPK1
SCHEMBL10386275 0.81 NT5E (0.51) APEX1NT5ECYP1A2CYP2C9MAPK1
SCHEMBL9748497 0.79 APEX1 (0.55) APEX1NT5ECYP1A2CYP2C9MAPK1
SCHEMBL21894602 0.78 NT5E (0.65) APEX1NT5ECYP1A2CYP2C9MAPK1
SCHEMBL9768417 0.78 APEX1 (0.45) APEX1NT5ECYP1A2CYP2C9MAPK1
SCHEMBL10383226 0.77 NT5E (0.52) APEX1NT5ECYP1A2CYP2C9MAPK1
SCHEMBL29495048 0.77 NT5E (0.63) APEX1NT5ECYP1A2CYP2C9MAPK1
SCHEMBL29013481 0.74 CYP1A2 (0.55) APEX1NT5ECYP1A2CYP2C9MAPK1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9394445-B2 Method for continuously preparing water-soluble azo dye by coupling a nebulizer with a pipeline DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2016-07-19 US disclosed
US-20150073132-A1 METHOD FOR CONTINUOUSLY PREPARING WATER-SOLUBLE AZO DYE BY COUPLING A NEBULIZER WITH A PIPELINE DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2015-03-12 US disclosed
CN-102618083-A Method for continuously preparing water-soluble azo dye by coupling atomizer and pipeline UNIV DALIAN TECH 2012-08-01 CN disclosed
CN-102618063-A Continuous preparation method of spiral tube chaotic mixing of water-soluble azo dye UNIV DALIAN TECH 2012-08-01 CN disclosed
US-5538518-A DYEING AND PRINTING OF COTTON AND POLYAMIDES; AZO DYES; COLOR- AND WASHFASTNESS; EXHAUSTION AND COLD PAD BATCH BAYER AKTIENGESELLSCHAFT (DE) 1996-07-23 US disclosed
US-5436324-A Colorfast reactive dyes for cellulose or polyamides BAYER AKTIENGESELLSCHAFT (DE) 1995-07-25 US disclosed
US-4206306-A Reactive phthalocyanine dyestuffs containing a fluorotriazinyl group attached via a nitrogen bridge to the dyestuff molecule BAYER AKTIENGESELLSCHAFT (DE) 1980-06-03 US disclosed
US-4115378-A TEXTILES BAYER AKTIENGESELLSCHAFT (DE) 1978-09-19 US disclosed