SCHEMBL4539862

SCHEMBL4539862

O=S(=O)(O)c1cc(S(=O)(=O)O)c2c[c]cc(S(=O)(=O)O)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
LCK P06239 1/20 0.34
FYN P06241 1/20 0.34
NT5E P21589 2/20 0.33
ING2 Q9H160 1/20 0.33
TIMP3 P35625 2/20 0.32
ENPP2 Q13822 1/20 0.32
NSD2 O96028 3/20 0.31
GAA P10253 1/20 0.31
PLCG1 P19174 1/20 0.31
DNMT1 P26358 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL3899723 0.84 ALDH1A1 (0.48) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL3823283 0.84 TTR (0.34)
SCHEMBL3816121 0.82 ALDH1A1 (0.47) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL3826191 0.82 ALDH1A1 (0.47) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL3817953 0.82 ALDH1A1 (0.47) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL11165914 0.82 ALDH1A1 (0.47) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL10649404 0.80 ALDH1A1 (0.41) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL6636077 0.75 ALDH1A1 (0.51) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL1809641 0.75 CASP6 (0.44) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL19179012 0.75 NT5E (0.52) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7381256-B2 Mixtures of fiber-reactive azo dyes, their production and their use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-06-03 US claimed
US-20070209540-A1 Mixtures Of Fiber-Reactive Azo Dyes, Their Production And Their Use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2007-09-13 US claimed
EP-1737915-A1 MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PRODUCTION AND THEIR USE DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2007-01-03 EP claimed
WO-2005100485-A1 MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PRODUCTION AND THEIR USE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2005-10-27 WO claimed
EP-0712841-B1 Process for the preparation of 3(N-aryl-amino)-propyl-2'-sulfatoethylsulfonyl compounds DYSTAR TEXTILFARBEN GMBH & CO (DE) 1999-01-13 EP claimed
US-5811081-A Use of hydroxybenzotriazoles for enhancing the sun protection factor of cellulosic fibre materials CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-09-22 US claimed
US-5777111-A DERIVATIVES OF ARYL SUBSTITUTED 1,3-OXAZINES HOECHST AKTIENGESELLSCHAFT (DE) 1998-07-07 US claimed
US-5672738-A REACTING AN AROMATIC SUBSTITUTED CYCLIC CARBAMATE WITH 2-MERCAPTETHANOL IN PRESENCE OF A BASIC CATALYST HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-30 US claimed
EP-0712841-A1 Process for the preparation of 3(N-aryl-amino)-propyl-2'-sulfatoethylsulfonyl compounds HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-22 EP claimed
EP-0708197-A2 Utilisation of hydroxybenztriazoles for increasing the sun-ray filter index of fibrous cellulosic materials CIBA-GEIGY AG (CH) 1996-04-24 EP claimed
EP-0303081-B1 WATER SOLUBLE DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1992-01-02 EP claimed
US-5055565-A Fiber-reactive dyes HOECHST AKTIENGESELLSCHAFT (DE) 1991-10-08 US claimed
EP-0231836-B1 WATER SOLUBLE DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1989-12-13 EP claimed
EP-0303081-A1 Water soluble disazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1989-02-15 EP claimed
EP-0231836-A2 Water soluble disazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1987-08-12 EP claimed
EP-0087113-B1 WATER SOLUBLE DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1986-09-03 EP claimed
EP-0068153-B1 DISAZO FIBRE-REACTIVE DYESTUFFS, THEIR PREPARATION AND THEIR USE BAYER AG (DE) 1985-12-11 EP claimed
EP-0050266-B1 REACTIVE DISAZO DYES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN DYEING AND PRINTING MATERIALS THAT CONTAIN HYDROXYL AND/OR NITROGEN BAYER AG (DE) 1984-10-03 EP claimed
US-20220162419-A1 COLORED CURABLE RESIN COMPOSITION, COLOR FILTER AND SOLID-STATE IMAGING ELEMENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2022-05-26 US disclosed
US-4329282-A Fluoro-triazine-containing fibre-reactive disazo dyestuffs BAYER AKTEINGESELLSCHAFT (DE) 1982-05-11 US disclosed