SCHEMBL6631111

SCHEMBL6631111

O=S(=O)(O)c1ccc2c(S(=O)(=O)O)cc[c]c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
HSD17B10 Q99714 4/20 0.40
CASP6 P55212 3/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 1/20 0.40
TIMP3 P35625 2/20 0.38
HPGD P15428 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TDP1 Q9NUW8 4/20 0.36
MEN1 O00255 2/20 0.36
THRB P10828 2/20 0.36
KMT2A Q03164 2/20 0.36
PRMT1 Q99873 1/20 0.36
LMNA P02545 1/20 0.35
NT5E P21589 3/20 0.35
NSD2 O96028 1/20 0.35
DUSP3 P51452 1/20 0.35
PTPN5 P54829 1/20 0.35
PTPN11 Q06124 1/20 0.35
TSHR P16473 2/20 0.34

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
SCHEMBL5147228 0.86 ALDH1A1 (0.44) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL7065098 0.83 ALDH1A1 (0.49) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL6631839 0.78 ALDH1A1 (0.37) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL1804225 0.77 TTR (0.43) ALDH1A1HSD17B10CYP2C9CYP2C19TSHR
SCHEMBL1413167 0.76 ALDH1A1 (0.42) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL7577043 0.75 ALDH1A1 (0.39) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL6631707 0.75 ALDH1A1 (0.43) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL30939652 0.74 ALDH1A1 (0.52) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL3296584 0.74 ALDH1A1 (0.52) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL7576088 0.73 NT5E (0.43) 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 30 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
CN-102643569-B Ink composite and use its ink jet recording method 精工爱普生株式会社 2016-12-14 CN disclosed
EP-2489706-B1 Ink composition and ink jet recording method using the same SEIKO EPSON CORP (JP) 2015-03-04 EP disclosed
US-8790458-B2 Ink set and droplet ejection apparatus using the ink set SEIKO EPSON CORPORATION (JP) 2014-07-29 US disclosed
US-8496746-B2 Ink composition and ink jet recording method using the same SEIKO EPSON CORPORATION (JP) 2013-07-30 US disclosed
US-20130002757-A1 INK SET AND DROPLET EJECTION APPARATUS USING THE INK SET SEIKO EPSON CORPORATION (JP) 2013-01-03 US disclosed
US-20120213930-A1 INK COMPOSITION AND INK JET RECORDING METHOD USING THE SAME SEIKO EPSON CORPORATION (JP) 2012-08-23 US disclosed
EP-2489706-A1 Ink composition and ink jet recording method using the same Seiko Epson Corporation (JP) 2012-08-22 EP disclosed
CN-102643569-A Ink composition and ink jet recording method using same SEIKO EPSON CORP 2012-08-22 CN disclosed
CN-1276035-C Water-color ink MITSUI CHEMICALS INC (JP) 2006-09-20 CN disclosed
US-6210448-B1 REACTING AN SUBSTITUTED AROMATIC AZO COMPOUND WHICH CAN BE METALLIZED WITH A CHROMIUM DONAR TO FORM A COMPLEX METALLIZED DYE CLARIANT FINANCE (BVI) LIMITED (VG) 2001-04-03 US disclosed
CN-1260815-A Method for dying aluminium oxide layers CLARIANT FINACE BVI LTD (VG) 2000-07-19 CN disclosed
CN-1257530-A 1 : 2 chromium complex dyes, the production and use thereof CLARIANT FINANCE BVI LTD (VG) 2000-06-21 CN disclosed
WO-2000009615-A1 1:2 CHROMIUM COMPLEX DYES, THEIR PRODUCTION AND USE CLARIANT FINANCE (BVI) LIMITED (VG) 2000-02-24 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-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-0538900-A2 Water-soluble azo compounds, process for their preparation and their use as dyes HOECHST AKTIENGESELLSCHAFT (DE) 1993-04-28 EP disclosed
EP-0409117-A1 Silver halide photographic material KONICA CORPORATION (JP) 1991-01-23 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