SCHEMBL31256

SCHEMBL31256

O=S(=O)(O)c1ccc(O)c(O)c1S(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
COMT P21964 1/20 0.43
NQO1 P15559 1/20 0.40
HSD17B10 Q99714 4/20 0.39
HPGD P15428 3/20 0.39
LMNA P02545 2/20 0.39
HIF1A Q16665 1/20 0.39
AURKA O14965 1/20 0.39
AURKB Q96GD4 1/20 0.39
ALDH1A1 P00352 3/20 0.38
TNNI3 P19429 2/20 0.38
TNNT2 P45379 2/20 0.38
TNNC1 P63316 2/20 0.38
LDHA P00338 1/20 0.38
HKDC1 Q2TB90 1/20 0.38
CYP2D6 P10635 1/20 0.37
PGAM1 P18669 1/20 0.35
CYP1A2 P05177 1/20 0.35
MPL P40238 1/20 0.35
KDM4E B2RXH2 2/20 0.34
USP2 O75604 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
SCHEMBL29373188 1.00 COMT (0.43) COMTNQO1HSD17B10HPGDLMNA
SCHEMBL3218328 0.98 COMT (0.42) COMTNQO1HSD17B10HPGDLMNA
SCHEMBL2552952 0.85 HSD17B10 (0.40) COMTNQO1HSD17B10HPGDLMNA
SCHEMBL7536401 0.85 CYP2D6 (0.39) COMTNQO1HSD17B10HPGDLMNA
Diethylamine SCHEMBL11763082 0.85 HIF1A (0.61) COMTNQO1HSD17B10HPGDLMNA
SCHEMBL4070129 0.84 COMT (0.42) COMTNQO1HSD17B10HPGDLMNA
SCHEMBL669153 0.83 COMT (0.44) COMTNQO1HSD17B10HPGDLMNA
SCHEMBL29373949 0.83 COMT (0.44) COMTNQO1HSD17B10HPGDLMNA
SCHEMBL8740780 0.83 COMT (0.44) COMTNQO1HSD17B10HPGDLMNA
SCHEMBL7756811 0.82 COMT (0.41) COMTNQO1HSD17B10HPGDLMNA

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

Appears in 4024 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108550884-A A kind of flow battery 西南交通大学 2018-09-18 CN claimed
EP-2417092-B1 PROCESS FOR THE HYDROXYLATION OF PHENOLS AND OF PHENOL ETHERS RHODIA OPERATIONS (FR) 2016-01-06 EP claimed
CN-102378749-B Process for the hydroxylation of phenols and of phenol ethers RHODIA OPERATIONS 2014-12-31 CN claimed
CN-103031196-B Emulsion type metal cutting fluid SHANGHAI TAOHONG CHEMICAL TECH 2014-12-03 CN claimed
US-8791308-B2 Process for the hydroxylation of phenols and of phenol ethers RHODIA OPERATIONS (FR) 2014-07-29 US claimed
CN-103031197-B Environment-friendly water-based synthetic cutting fluid SHANGHAI TAOHONG CHEMICAL TECH 2014-04-02 CN claimed
CN-102046693-B Process for producing aliphatic polyester resin and aliphatic polyester resin composition TORAY FIBER RES INST CN CO LTD 2013-08-21 CN claimed
CN-102083778-B Process for hydroxylation of phenol RHODIA OPERATIONS 2013-07-31 CN claimed
CN-103031197-A Environment-friendly water-based synthetic cutting fluid SHANGHAI TAOHONG CHEMICAL TECH 2013-04-10 CN claimed
CN-103031196-A Emulsion type metal cutting fluid SHANGHAI TAOHONG CHEMICAL TECH 2013-04-10 CN claimed
US-6048836-A MIXTURE CONTAINING MICROBIOCIDE AD PEROXY BLEACH THE PROCTER & GAMBLE COMPANY (US) 2000-04-11 US claimed
WO-1999065703-A1 INKJET RECEPTOR MEDIA COMPRISING METALLIC SALTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-12-23 WO claimed
CN-1229335-A Use of a mixture of surfactants, chelating agents and essential oils for effective disinfection PROCTER & GAMBLE (US) 1999-09-22 CN claimed
US-5919271-A DETERGENT SURFACTANT, NONIONIC POLYSACCHARIDE ETHER, CELLULOLYTIC ENZYME, CHELATING AGENT, DYE TRANSFER INHIBITING AGENT PROCTER & GAMBLE COMPANY (US) 1999-07-06 US claimed
EP-0912098-A1 USE OF A COMBINATION OF SURFACTANTS, CHELATING AGENTS AND ESSENTIAL OILS FOR EFFECTIVE DISINFECTION THE PROCTER & GAMBLE COMPANY (US) 1999-05-06 EP claimed
WO-1999018180-A1 PEROXYGEN BLEACH-CONTAINING COMPOSITIONS COMPRISING A PARTICULAR CHELATING AGENT SYSTEM THE PROCTER & GAMBLE COMPANY (US) 1999-04-15 WO claimed
EP-0906950-A1 Peroxygen bleach-containing compositions comprising a particular chelating agent system THE PROCTER & GAMBLE COMPANY (US) 1999-04-07 EP claimed
EP-0873106-A1 USE OF METALLOFLUOROCOMPLEXES FOR DENTAL COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-10-28 EP claimed
WO-1998002044-A1 USE OF A COMBINATION OF SURFACTANTS, CHELATING AGENTS AND ESSENTIAL OILS FOR EFFECTIVE DISINFECTION THE PROCTER & GAMBLE COMPANY (US) 1998-01-22 WO claimed
WO-1997018791-A1 USE OF METALLOFLUOROCOMPLEXES FOR DENTAL COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-05-29 WO claimed