SCHEMBL6597399

SCHEMBL6597399

O=S(=O)(O)c1cc(S(=O)(=O)O)c2cc(S(=O)(=O)O)c[c]c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CASP6 P55212 2/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
LCK P06239 1/20 0.37
FYN P06241 1/20 0.37
TIMP3 P35625 3/20 0.34
ENPP2 Q13822 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NT5E P21589 2/20 0.33
ING2 Q9H160 1/20 0.32
NSD2 O96028 2/20 0.30
PRMT1 Q99873 1/20 0.30
GAA P10253 1/20 0.30
PLCG1 P19174 1/20 0.30

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
SCHEMBL10647068 0.81 ALDH1A1 (0.51) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL3823429 0.80 TSHR (0.39) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL6634015 0.79 TTR (0.42) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL3899723 0.78 ALDH1A1 (0.48) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL3816121 0.76 ALDH1A1 (0.47) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL3826191 0.76 ALDH1A1 (0.47) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL11165914 0.76 ALDH1A1 (0.47) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL3817953 0.76 ALDH1A1 (0.47) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL6631839 0.76 ALDH1A1 (0.37) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL3917232 0.73 LMNA (0.37) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-1029002-B1 REACTIVE DYES CONTAINING A HALOBENZENE NUCLEUS DYSTAR TEXTILFARBEN GMBH & CO (DE) 2004-05-12 EP disclosed
US-20030191293-A1 Reactive dyes containing a halobenzene nucleus BASF AKIENGESELLSCHAFT (DE) 2003-10-09 US disclosed
US-20030158395-A1 Reactive dyes containing a halobenzene nucleus BASF AKIENGESELLSCHAFT (DE) 2003-08-21 US disclosed
EP-1333062-A1 Reactive dyes containing a halobenzene nucleus DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2003-08-06 EP disclosed
US-6399751-B1 REACTION PRODUCT BASF AKTIENGESELLSCHAFT (DE) 2002-06-04 US disclosed
EP-0876430-B1 BRANCHED POLYAMINE LINKED REACTIVE DYES AND COLORATION PROCESS USING THEM SYNGENTA LTD (GB) 2001-08-29 EP disclosed
EP-0576143-B1 Reactive dyes containing a 2,6-difluoro-3,5-dichloropyridine-4-ylamino group BASF AG (DE) 2000-08-09 EP disclosed
US-6059870-A WATER SOLUBLE REACTIVE DYE ZENECA LIMITED (GB) 2000-05-09 US disclosed
US-6022384-A Negative dyes and coloration process using them ZENECA LIMITED (GB) 2000-02-08 US disclosed
WO-1997040108-A1 INKS AND TONERS COMPRISING WATER-SOLUBLE REACTIVE DYES LINKED TO A POLYAMINE ZENECA LIMITED (GB) 1997-10-30 WO disclosed
WO-1997027250-A1 DYES CONTAINING A 2,4,5-TRIFLUORO-3,6-DICYANOPHENYL REACTIVE GROUP AND USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 1997-07-31 WO disclosed
WO-1997019137-A1 NEGATIVE DYES AND COLORATION PROCESS USING THEM ZENECA LIMITED (GB) 1997-05-29 WO disclosed
EP-0538900-B1 Water-soluble azo compounds, process for their preparation and their use as dyes HOECHST AG (DE) 1997-03-05 EP disclosed
US-5373094-A Reactive dyes containing a 2,6-difluoro-3,5-dichloropyridine group ZENECA LIMITED (GB) 1994-12-13 US disclosed
US-5292871-A Water-soluble compounds having a fiber-reactive group of the vinyl sulfone monoazo series bonded to an alkanoylamino of benzoylamino grouping, suitable as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1994-03-08 US disclosed
EP-0576143-A2 Reactive dyes containing a 2,6-difluoro-3,5-dichloropyridine-4-ylamino group ZENECA LIMITED (GB) 1993-12-29 EP disclosed
EP-0538900-A2 Water-soluble azo compounds, process for their preparation and their use as dyes HOECHST AKTIENGESELLSCHAFT (DE) 1993-04-28 EP disclosed
EP-0087113-B1 WATER SOLUBLE DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1986-09-03 EP disclosed
EP-0087113-A2 Water soluble disazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1983-08-31 EP disclosed