SCHEMBL446403

SCHEMBL446403

CCCCCCCCCCCCc1ccc(S(=O)(=O)[O-])cc1.[Na+]

nearest known ligand 0.66

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
CA2 known ✓ P00918 3/20 0.66
ADORA3 known ✓ P0DMS8 2/20 0.53
PTGS1 known ✓ P23219 1/20 0.53
ADORA2A known ✓ P29274 1/20 0.53
PTGS2 known ✓ P35354 1/20 0.53
CA12 known ✓ O43570 1/20 0.52
CA1 known ✓ P00915 1/20 0.52
LMNA P02545 3/20 0.59
HIF1A Q16665 2/20 0.59
HTT P42858 2/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
TSHR P16473 1/20 0.59
CYP2C19 P33261 1/20 0.59
KCNH2 Q12809 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.58
NR1I2 O75469 1/20 0.55
ESR1 P03372 2/20 0.53
ADRA2A P08913 2/20 0.53
TACR2 P21452 2/20 0.53

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
SCHEMBL2457843 1.00 CA2 (0.66) CA2LMNAHIF1AHTTCYP2D6
SCHEMBL11057835 1.00 CA2 (0.66) CA2LMNAHIF1AHTTCYP2D6
SCHEMBL1448849 1.00 CA2 (0.66) CA2LMNAHIF1AHTTCYP2D6
SCHEMBL11450888 1.00 CA2 (0.66) CA2LMNAHIF1AHTTCYP2D6
SCHEMBL149982 1.00 CA2 (0.66) CA2LMNAHIF1AHTTCYP2D6
SCHEMBL3860078 1.00 CA2 (0.66) CA2LMNAHIF1AHTTCYP2D6
SCHEMBL11059907 1.00 CA2 (0.66) CA2LMNAHIF1AHTTCYP2D6
SCHEMBL11712823 1.00 CA2 (0.66) CA2LMNAHIF1AHTTCYP2D6
SCHEMBL3853262 1.00 CA2 (0.66) CA2LMNAHIF1AHTTCYP2D6
SCHEMBL28490846 1.00 CA2 (0.66) CA2LMNAHIF1AHTTCYP2D6

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 1393 patents — showing the first 20. 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
WO-2025099063-A1 MULTILAYER NERVE REGENERATION GUIDANCE TUBE EVONIK OPERATIONS GMBH (DE) 2025-05-15 WO claimed
WO-2025057073-A1 SYNERGISTIC HERBICIDAL FORMULATION COMPRISING PYROXASULFONE AND PROCESS FOR PREPARATION THEREOF SHETTY SADASHIV KANYANA (IN) 2025-03-20 WO claimed
CN-119258474-A Fire extinguishing composition 海浚国际贸易有限公司 2025-01-07 CN claimed
CN-119044365-A Treatment method of electroplating solution and test method of dispersing agent in sample to be tested 温州泰钰新材料科技有限公司 2024-11-29 CN claimed
WO-2024218765-A2 HAIR TREATMENT COMPOSITIONS AND METHODS A. MESHI COSMETIC INDUSTRIES LTD. (IL) 2024-10-24 WO claimed
CN-113388064-B Water-based acrylic emulsion for battery protection film and preparation method thereof 东莞澳中新材料科技股份有限公司 2024-01-09 CN claimed
CN-112479529-B Dry distillation process for treating oil sludge 湖北爱国环保技术开发有限公司 2023-12-05 CN claimed
EP-4263690-A1 LONG-TERM FIRE RETARDANT WITH CORROSION INHIBITORS AND METHODS FOR MAKING AND USING SAME FRS Group, LLC (US) 2023-10-25 EP claimed
CN-114642208-B Fluazinam water dispersible granule and preparation method thereof 山东潍坊润丰化工股份有限公司 2023-07-21 CN claimed
US-20050048086-A1 Compositions and dosage forms for gasteric delivery of antineoplastic agents and methods of treatment that use them to inhibit cancer cell proliferation FLASHNER-BARAK MOSHE (IL) 2005-03-03 US claimed
CN-1568693-A Wheat composite herbicide used after seedling emergence FANG JIANGSHENG (CN) 2005-01-26 CN claimed
US-20020147208-A1 Compositions and dosage forms for gastric delivery of antineoplastic agents and methods of treatment that use them to inhibit cancer cell proliferation TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2002-10-10 US claimed
CN-1356041-A Composition series of herbicides for before-seedling stage in soybean, corn or peanut field WANG CHUNSHENG (CN) 2002-07-03 CN claimed
CN-1337159-A Herbicide for corn field CHENG YIZHONG (CN) 2002-02-27 CN claimed
US-5378780-A DISCONTINUOUS POLYMERIZATION IN THE PRESENCE OF AN EFFECTIVE AMOUNT OF A MONOMER SOLUBLE CATALYST AND A PREDISPERSION OF AN EMULSIFIER, AN ALKANOL AND WATER HULS AKTIENGESELLSCHAFT (DE) 1995-01-03 US claimed
US-5152933-A Mixtures of anionic and nonionic surfactants, improved removal of both oily and particulate soils BASF CORPORATION (US) 1992-10-06 US claimed
US-4631324-A EMULSIFIER SYSTEM OF SULFONATE AND FATTY ALCOHOL HUELS AKTIENGESELLSCHAFT (DE) 1986-12-23 US claimed
US-4374953-A Method for preparing polyacetals and polyketals by emulsion polymerization DOW CORNING CORPORATION (US) 1983-02-22 US claimed
US-4098972-A ANTISCALING AGENTS SHIN-ETSU CHEMICAL CO., LTD. (JP) 1978-07-04 US claimed