SCHEMBL2093555

SCHEMBL2093555

Nc1ccc(S(=O)(=O)[O-])c2ccccc12.[Na+]

nearest known ligand 0.56

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB known ✓ P10828 2/20 0.47
NR4A1 P22736 1/20 0.56
TTR P02766 1/20 0.48
ALDH1A1 P00352 2/20 0.44
CYP3A4 P08684 2/20 0.44
HPGD P15428 2/20 0.44
TSHR P16473 2/20 0.44
HSD17B10 Q99714 2/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
MAPK1 P28482 1/20 0.44
RECQL P46063 1/20 0.44
APP P05067 1/20 0.44
GLB1 P16278 1/20 0.44
CHAT P28329 1/20 0.44
ENPP2 Q13822 1/20 0.44
PHLPP2 Q6ZVD8 1/20 0.44
CTRC Q99895 1/20 0.44
SLC7A11 Q9UPY5 3/20 0.42
NSD2 O96028 5/20 0.42

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
SCHEMBL7179151 1.00 NR4A1 (0.56) NR4A1TTRTHRBALDH1A1CYP3A4
SCHEMBL30742565 1.00 NR4A1 (0.56) NR4A1TTRTHRBALDH1A1CYP3A4
SCHEMBL29354786 1.00 NR4A1 (0.56) NR4A1TTRTHRBALDH1A1CYP3A4
Water SCHEMBL29985321 0.98 NR4A1 (0.54) NR4A1TTRTHRBALDH1A1CYP3A4
Water SCHEMBL28335545 0.98 NR4A1 (0.54) NR4A1TTRTHRBALDH1A1CYP3A4
Potassium Ion SCHEMBL28792184 0.96 NR4A1 (0.60) NR4A1TTRTHRBALDH1A1CYP3A4
Lithium Ion SCHEMBL20420823 0.96 NR4A1 (0.56) NR4A1TTRTHRBALDH1A1CYP3A4
SCHEMBL2951288 0.88 TTR (0.63) NR4A1TTRALDH1A1CYP3A4HPGD
Lithium Ion SCHEMBL20420825 0.84 TTR (0.63) NR4A1TTRALDH1A1CYP3A4HPGD
SCHEMBL10383985 0.80 NSD2 (0.44) NR4A1TTRTHRBALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119954991-A High oxygen permeability ionomer with large steric hindrance group, and preparation method and application thereof 武汉大学 2025-05-09 CN claimed
CN-119368337-A Copper-molybdenum collector and preparation method and application thereof 昆明冶金研究院有限公司 2025-01-28 CN claimed
CN-118439581-A High-first-efficiency hard carbon composite material and preparation method thereof 安徽天宏基科技有限公司 2024-08-06 CN claimed
CN-221310035-U Green preparation system of 1-amino-4-sodium naphthalene sulfonate 三门峡新鑫源科技有限公司 2024-07-12 CN claimed
CN-116273159-B Sulfonated immobilized binary catalyst, preparation method and application thereof 中国人民解放军军事科学院系统工程研究院 2023-11-17 CN claimed
CN-116768271-A Molybdenum disulfide nanosheets and large-scale preparation method thereof 上海大学 2023-09-19 CN claimed
CN-116273159-A Sulfonated immobilized binary catalyst, preparation method and application thereof 中国人民解放军军事科学院系统工程研究院 2023-06-23 CN claimed
CN-217989249-U A batching cauldron for producing 1-naphthylamine-4-sodium sulfonate 焦作润扬化工科技有限公司 2022-12-09 CN claimed
CN-109983339-B Method for estimating concentration of foundation injection agent 株式会社竹中工务店 2022-08-05 CN claimed
CN-112852396-B Multifunctional blocking remover and preparation method thereof 中国石油天然气股份有限公司 2022-05-10 CN claimed
EP-1021483-B1 WATER-REDISPERSIBLE FILM-FORMING POLYMER POWDERS PREPARED FROM ETHYLENICALLY UNSATURATED MONOMERS AND CONTAINING NAPHTHALENESULPHONATES RHODIA CHIMIE SA (FR) 2004-04-07 EP claimed
US-6638488-B1 Method and apparatus for removing organic hazardous substances using selected solvents AKAE YUKOH (JP) 2003-10-28 US claimed
US-20030176757-A1 Method for recombining soil AKAE YUKOH (JP) 2003-09-18 US claimed
US-20020111528-A1 Method for recombining soil AKAE YUKOH (JP) 2002-08-15 US claimed
US-6391952-B1 ETHYLENIC UNSATURATED MONOMER FORMING WATER INSOLUBLE FILMS RHODIA CHIMIE (FR) 2002-05-21 US claimed
EP-1196219-A1 METHODS FOR NEUTRALIZING/DETOXIFYING HAZARDOUS COMPOUNDS AND STABLE SOLIDIFYING METHOD Akae, Yukoh (JP) 2002-04-17 EP claimed
WO-2001058611-A1 METHOD FOR MANUFACTURING SOIL FIXING AGENTS AND USING THE AGENTS TO FIX THE SOIL AKAE YUKOH (JP) 2001-08-16 WO claimed
WO-2001036050-A1 METHODS FOR NEUTRALIZING/DETOXIFYING HAZARDOUS COMPOUNDS AND STABLE SOLIDIFYING METHOD AKAE YUKOH (JP) 2001-05-25 WO claimed
US-5986161-A NEUTRALIZATION AND FIXING HAZARDOUS WASTE METALS, ADDING SODIUM NITRITE AND NAPHTHYLAMINE-4-SULFONATE AKAE YUKOH (JP) 1999-11-16 US claimed
US-5500668-A INK JET PRINTING XEROX CORPORATION (US) 1996-03-19 US claimed