SCHEMBL3936742

SCHEMBL3936742

O=S(=O)([O-])c1cccc(C=Cc2ccccc2)c1S(=O)(=O)[O-].[Na+].[Na+]

nearest known ligand 0.41

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 14)

geneUniProtsupporting neighboursconfidence
PPARG known ✓ P37231 1/20 0.37
NFE2L2 Q16236 6/20 0.41
TRPA1 O75762 2/20 0.41
RAD51 Q06609 3/20 0.40
DPYD Q12882 1/20 0.37
LMNA P02545 1/20 0.37
NR1H2 P55055 1/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
KCNH2 Q12809 1/20 0.35
SLC16A3 O15427 1/20 0.35
CHAT P28329 1/20 0.35
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35

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
SCHEMBL27453977 0.86 RAD51 (0.48) NFE2L2TRPA1RAD51DPYDLMNA
SCHEMBL29612146 0.86 TRPA1 (0.38) NFE2L2TRPA1RAD51DPYDLMNA
SCHEMBL38569 0.86 RAD51 (0.36) NFE2L2TRPA1RAD51LMNAPPARG
SCHEMBL14484832 0.85 NFE2L2 (0.42) NFE2L2TRPA1RAD51LMNAPPARG
SCHEMBL14484833 0.85 NFE2L2 (0.42) NFE2L2TRPA1RAD51LMNAPPARG
SCHEMBL2524357 0.85 NFE2L2 (0.42) NFE2L2TRPA1RAD51DPYDLMNA
(Z)-1,2-Diphenylethene SCHEMBL28675607 0.81 PTPN1 (0.39) NFE2L2RAD51
SCHEMBL28674571 0.80 RAD51 (0.38) NFE2L2TRPA1RAD51LMNAPPARG
SCHEMBL183119 0.77 RAD51 (0.42) NFE2L2TRPA1RAD51HTR2AHTR2C
SCHEMBL15788912 0.77 RAD51 (0.42) NFE2L2TRPA1RAD51HTR2AHTR2C

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120059168-A Dyeing auxiliary and easy-to-dye polyurethane urea elastic fiber containing same 华峰化学股份有限公司 2025-05-30 CN claimed
CN-119708965-A Plasma cutting protection liquid and preparation method and application thereof 深圳市化讯半导体材料有限公司 2025-03-28 CN claimed
CN-119661992-A Low-temperature extinction transparent polyester resin composition, and preparation method and application thereof 擎天材料科技有限公司 2025-03-21 CN claimed
CN-115506030-B Monocrystalline silicon wet etching texturing additive, monocrystalline silicon wet etching texturing liquid containing monocrystalline silicon wet etching texturing additive, preparation method and application of monocrystalline silicon wet etching texturing additive 浙江奥首材料科技有限公司 2024-02-27 CN claimed
CN-117110209-A Device and method for detecting and evaluating grouting effect of hidden danger of dam structure 水利部交通运输部国家能源局南京水利科学研究院 2023-11-24 CN claimed
CN-115584662-B Paper-plastic protection piece for furniture corner positions, preparation method and paper-plastic protection assembly structure 东莞市加隆纸塑包装有限公司 2023-10-27 CN claimed
CN-113710753-B Washable heat and plasma resistant coating for laser applications 约翰·克莱昂·摩尔 2023-09-19 CN claimed
CN-120119485-A Archival paper and manufacturing method thereof 亚太森博(山东)浆纸有限公司 2025-06-10 CN disclosed
CN-120059168-A Dyeing auxiliary and easy-to-dye polyurethane urea elastic fiber containing same 华峰化学股份有限公司 2025-05-30 CN disclosed
CN-119661992-A Low-temperature extinction transparent polyester resin composition, and preparation method and application thereof 擎天材料科技有限公司 2025-03-21 CN disclosed
CN-115506030-B Monocrystalline silicon wet etching texturing additive, monocrystalline silicon wet etching texturing liquid containing monocrystalline silicon wet etching texturing additive, preparation method and application of monocrystalline silicon wet etching texturing additive 浙江奥首材料科技有限公司 2024-02-27 CN disclosed
CN-115506030-B Monocrystalline silicon wet etching texturing additive, monocrystalline silicon wet etching texturing liquid containing monocrystalline silicon wet etching texturing additive, preparation method and application of monocrystalline silicon wet etching texturing additive 浙江奥首材料科技有限公司 2024-02-27 CN disclosed
CN-115584662-B Paper-plastic protection piece for furniture corner positions, preparation method and paper-plastic protection assembly structure 东莞市加隆纸塑包装有限公司 2023-10-27 CN disclosed
US-11753608-B2 Water-soluble unit dose articles comprising perfume THE PROCTER & GAMBLE COMPANY (US) 2023-09-12 US disclosed
US-20210238513-A1 WATER-SOLUBLE UNIT DOSE ARTICLES COMPRISING PERFUME PROCTER & GAMBLE (US) 2021-08-05 US disclosed
CN-107075489-A Alicyclic acid bacillus variant and the polynucleotides for encoding them 诺维信公司 2017-08-18 CN disclosed
CN-107002057-A Liquid cleaning compositions comprising protease variants 诺维信公司 2017-08-01 CN disclosed
WO-2009017288-A1 PROCESS FOR PREPARATION OF DISODIUM STILBENEDISULFONATES SK ENERGY CO., LTD. (KR) 2009-02-05 WO disclosed