SCHEMBL10840922

SCHEMBL10840922

Cc1cc(C)cc(S(=O)(=O)[O-])c1.[Na+]

nearest known ligand 0.54

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
CA12 known ✓ O43570 2/20 0.37
CA1 known ✓ P00915 2/20 0.37
CA2 known ✓ P00918 2/20 0.37
TLR9 known ✓ Q9NR96 1/20 0.36
LMNA P02545 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
DUSP5 Q16690 3/20 0.45
PTPN1 P18031 2/20 0.45
DUSP6 Q16828 1/20 0.45
RAPGEF4 Q8WZA2 4/20 0.40
GAA P10253 1/20 0.40
FFAR4 Q5NUL3 1/20 0.38
CA9 Q16790 2/20 0.37
CA3 P07451 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
TSHR P16473 1/20 0.37
PKLR P30613 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
Potassium Ion SCHEMBL21056187 0.95 LMNA (0.48) LMNATDP1DUSP5PTPN1DUSP6
Lithium Ion SCHEMBL29080948 0.95 LMNA (0.48) LMNATDP1DUSP5PTPN1DUSP6
SCHEMBL10452210 0.81 LMNA (0.42) LMNATDP1DUSP5PTPN1DUSP6
SCHEMBL124132 0.80 DUSP5 (0.54) LMNATDP1DUSP5PTPN1DUSP6
SCHEMBL6829964 0.77 TDP1 (0.57) LMNATDP1
SCHEMBL6832057 0.77 TDP1 (0.57) LMNATDP1
SCHEMBL10663598 0.76 GAA (0.62) LMNATDP1RAPGEF4GAACA12
SCHEMBL10917087 0.76 GAA (0.62) LMNATDP1RAPGEF4GAACA12
SCHEMBL16034285 0.76 GAA (0.62) LMNATDP1RAPGEF4GAACA12
SCHEMBL57154 0.76 GAA (0.62) LMNATDP1RAPGEF4GAACA12

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
US-20250304805-A1 PEELING LIQUID COMPOSITION AND METHOD FOR PRODUCING RECYCLED ALUMINUM SUBSTRATE FUJIFILM BUSINESS INNOVATION CORP. (JP) 2025-10-02 US claimed
CN-114621046-B Method for preparing high-purity dicyclopentadiene through ionic liquid catalysis 淄博鲁华泓锦新材料集团股份有限公司 2024-01-09 CN claimed
CN-116375907-A Method for producing sugammadex 默沙东有限责任公司 2023-07-04 CN claimed
US-20210206884-A1 PROCESSES FOR THE PREPARATION OF SUGAMMADEX MERCK SHARP & DOHME CORP. (US) 2021-07-08 US claimed
EP-3802627-A1 PROCESSES FOR THE PREPARATION OF SUGAMMADEX Merck Sharp & Dohme Corp. (US) 2021-04-14 EP claimed
CN-112449642-A Process for preparing sugammadex 默沙东公司 2021-03-05 CN claimed
US-20250304805-A1 PEELING LIQUID COMPOSITION AND METHOD FOR PRODUCING RECYCLED ALUMINUM SUBSTRATE FUJIFILM BUSINESS INNOVATION CORP. (JP) 2025-10-02 US disclosed
CN-119101965-A Compound dispersing agent and compound plating solution 温州泰钰新材料科技有限公司 2024-12-10 CN disclosed
CN-112795240-B Ink for inkjet and image forming method 京瓷办公信息系统株式会社 2023-09-26 CN disclosed
CN-112795240-A Ink for ink jet and image forming method 京瓷办公信息系统株式会社 2021-05-14 CN disclosed
CN-111302947-A Synthetic method of 3, 5-dimethylaniline 江苏宝灵化工股份有限公司 2020-06-19 CN disclosed
EP-3496699-A1 N-METHYL-N-((2S,3R,4R,5R)-2,3,4,5,6-PENTAHYDROXYHEXYL)-(Z)-OCTADEC-9-ENAMIDE FOR REDUCTION OF EYE IRRITATION Werner & Mertz GmbH (DE) 2019-06-19 EP disclosed
CN-103734127-B Novel biologically bactericidal dispersing agent and preparation method thereof XINJIANG DE AN ENVIRONMENTAL PROT TECHNOLOGY CO LTD 2015-04-08 CN disclosed
CN-103734127-A Novel biologically bactericidal dispersing agent and preparation method thereof XINJIANG DE AN ENVIRONMENTAL PROT TECHNOLOGY CO LTD 2014-04-23 CN disclosed
US-4633024-A Process for producing aromatic hydroxy compound KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1986-12-30 US disclosed
EP-0092772-B1 PROCESS FOR PRODUCING AROMATIC HYDROXY COMPOUND Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1986-07-23 EP disclosed
EP-0092772-A1 Process for producing aromatic hydroxy compound Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1983-11-02 EP disclosed
US-4001313-A MANUFACTURE OF AROMATIC AMINO COMPOUNDS OSAKA CITY (JA) 1977-01-04 US disclosed