SCHEMBL6561236

SCHEMBL6561236

Nc1ccccc1C(=O)Nc1ccc2cc(S(=O)(=O)O)cc(O)c2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NT5E P21589 2/20 0.66
CASP6 P55212 4/20 0.59
NSD2 O96028 3/20 0.59
DUSP3 P51452 2/20 0.59
PTPN5 P54829 2/20 0.59
PTPN11 Q06124 2/20 0.59
CASP7 P55210 1/20 0.59
CTDSP1 Q9GZU7 1/20 0.57
PRMT1 Q99873 1/20 0.53
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ENPP2 Q13822 2/20 0.48
FADS1 O60427 3/20 0.47
ALDH1A1 P00352 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HSD17B10 Q99714 1/20 0.46
PTGS1 P23219 2/20 0.44

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
SCHEMBL6560722 0.92 CASP6 (0.67) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL11208058 0.85 NT5E (0.62) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL11204762 0.85 NT5E (0.62) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL7814945 0.83 CASP6 (0.68) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL6017879 0.81 CASP6 (0.84) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL6559613 0.81 CASP6 (0.65) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL8439783 0.80 NT5E (1.00) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL10900036 0.80 PRMT1 (0.81) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL29384348 0.80 PRMT1 (0.81) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL11582870 0.80 CASP6 (0.64) NT5ECASP6NSD2DUSP3PTPN5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1055710-B1 Water-soluble fibre-reactive dyestuffs, process for their preparation and their use DYSTAR TEXTILFARBEN GMBH & CO (DE) 2004-08-11 EP disclosed
US-6444794-B1 COMPLEXING WITH SUBSTRATE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2002-09-03 US disclosed
EP-0675172-B1 Water-solable azo compounds, process for their preparation and their use as dyestuffs DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-04-11 EP disclosed
EP-1055710-A1 Water-soluble fibre-reactive dyestuffs, process for their preparation and their use DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2000-11-29 EP disclosed
EP-0838504-B1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof DYSTAR TEXTILFARBEN GMBH & CO (DE) 2000-06-07 EP disclosed
US-6060591-A FOR DYEING A MATERIAL CONTAINING HYDROXY OR CARBOXAMIDE GROUPS OR BOTH DY STAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND K.G. (DE) 2000-05-09 US disclosed
CN-1235992-A Water-soluble fiber-reactive dyes, processes for their preparation and their use HOECHST AG (DE) 1999-11-24 CN disclosed
US-5834601-A DYEING CELLULOSE, WOOL, POLYAMIDE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-11-10 US disclosed
US-5770709-A BRILLIANT COLOR SHADES, GOOD FASTNESS DURING USE AT HIGH DEGREE OF FIXING DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 1998-06-23 US disclosed
EP-0848042-A2 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1998-06-17 EP disclosed
CN-1108674-A Water-soluble azo compounds, preparation thereof, and use thereof as dyes HOECHST AG (DE) 1995-09-20 CN disclosed
EP-0629667-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1994-12-21 EP disclosed
US-5334709-A Fiber-reactive dyes for cellulose materials, wool, polyamides; deep shades HOECHST AG (DE) 1994-08-02 US disclosed
EP-0542214-B1 Water-soluble fibre-reactive dyes, process for their preparation and the use thereof HOECHST AG (DE) 1994-05-25 EP disclosed
US-5280110-A Fiber-reactive dye HOECHST AKTIENGESELLSCHAFT (DE) 1994-01-18 US disclosed
EP-0575744-A1 Silane-containing dyestuffs, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-12-29 EP disclosed
US-5225544-A FIBER REACTIVE DYES WHICH CONTAIN A CYANOAMINOTRIAZINYL GROUP AND ONE OR TWO GROUPS OF THE VINYL SULFONE SERIES HOECHST AKTIENGESELLSCHAFT (DE) 1993-07-06 US disclosed
EP-0548792-A2 Water-soluble reactive dyes, their manufacture and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-06-30 EP disclosed
EP-0548795-A2 Water-soluble reactive dyes, their manufacture and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-06-30 EP disclosed
EP-0542214-A2 Water-soluble fibre-reactive dyes, process for their preparation and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1993-05-19 EP disclosed