SCHEMBL6595683

SCHEMBL6595683

O=S(=O)(O)c1[c]c2cc(S(=O)(=O)O)cc(S(=O)(=O)O)c2cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 4/20 0.36
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 2/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NSD2 O96028 3/20 0.34
NT5E P21589 3/20 0.34
DUSP3 P51452 2/20 0.34
PTPN5 P54829 2/20 0.34
PTPN11 Q06124 2/20 0.34
CASP7 P55210 1/20 0.33
ENPP2 Q13822 1/20 0.32
MAPK1 P28482 1/20 0.32
PRMT1 Q99873 1/20 0.32
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32
TSHR P16473 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ING2 Q9H160 1/20 0.31
TNNI3 P19429 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
SCHEMBL7577043 0.87 ALDH1A1 (0.39) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL7068961 0.82 ALDH1A1 (0.41) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL6631707 0.77 ALDH1A1 (0.43) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL8747432 0.76 TTR (0.44) ALDH1A1HSD17B10NSD2DUSP3TNNI3
SCHEMBL6630329 0.74 ALDH1A1 (0.42) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL6631839 0.73 ALDH1A1 (0.37) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL6631686 0.72 MPL (0.41) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL29093382 0.72 ALDH1A1 (0.41) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL3899723 0.71 ALDH1A1 (0.48) CASP6ALDH1A1HSD17B10CYP2C9CYP2C19
SCHEMBL8698065 0.70 ALDH1A1 (0.36) 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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
WO-2003006560-A2 AQUEOUS INK FORMULATIONS FOR INKJET PRINTING DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2003-01-23 WO disclosed
US-6399751-B1 REACTION PRODUCT BASF AKTIENGESELLSCHAFT (DE) 2002-06-04 US disclosed
EP-1127923-A2 Water-soluble fibre-reactive dyestuffs, process for their preparation and their use DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2001-08-29 EP disclosed
EP-0876430-B1 BRANCHED POLYAMINE LINKED REACTIVE DYES AND COLORATION PROCESS USING THEM SYNGENTA LTD (GB) 2001-08-29 EP disclosed
EP-0971986-B1 REACTIVE DYES CONTAINING A PERMANENT QUATERNARY AMMONIUM GROUP DYSTAR L P (US) 2001-06-27 EP disclosed
EP-0624630-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1994-11-17 EP 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
US-5175261-A Useful for coloring cellulose materials, animal furs or leather IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-12-29 US disclosed
EP-0471454-A1 Reactive pyridone azo dyestuffs ZENECA LIMITED (GB) 1992-02-19 EP disclosed
EP-0303081-B1 WATER SOLUBLE DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1992-01-02 EP disclosed
US-5055565-A Fiber-reactive dyes HOECHST AKTIENGESELLSCHAFT (DE) 1991-10-08 US disclosed
EP-0395207-A1 New reactive dyes ZENECA LIMITED (GB) 1990-10-31 EP disclosed
EP-0303081-A1 Water soluble disazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1989-02-15 EP disclosed