SCHEMBL149982

SCHEMBL149982

CCCCCCCCCCc1ccc(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
SCHEMBL446403 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 1631 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025024302-A1 EDIBLE COATING COMPOSITIONS APEEL TECHNOLOGY, INC. (US) 2025-01-30 WO claimed
CN-114174381-B Process for purifying polyether polyols 陶氏环球技术有限责任公司 2024-06-04 CN claimed
WO-2023243905-A1 POLISHING SLURRY COMPOSITION FOR SILICON CARBIDE WAFER 주식회사 케이씨텍 2023-12-21 WO claimed
CN-116789523-A Process for preparing vicinal diols 中国石油化工股份有限公司 2023-09-22 CN claimed
EP-2843002-B1 ORGANOPOLYSILOXANE EMULSION COMPOSITION SHINETSU CHEMICAL CO (JP) 2022-04-06 EP claimed
CN-106698369-B A kind of two dimension black phosphorus nanometer sheet and its liquid phase strip preparation method 深圳大学 2019-01-15 CN claimed
CN-106672927-B A kind of porous black phosphorus material of two-dimensional layer and preparation method thereof 深圳大学 2018-09-14 CN claimed
US-10034387-B2 Method for recycling of obsolete printed circuit boards ENTEGRIS, INC. (US) 2018-07-24 US claimed
CN-107416784-A A kind of two-dimentional black phosphorus nanometer sheet and its liquid phase strip preparation method 深圳大学 2017-12-01 CN claimed
US-9731368-B2 Apparatus and method for stripping solder metals during the recycling of waste electrical and electronic equipment ENTEGRIS, INC. (US) 2017-08-15 US claimed
EP-0979266-A2 NOVEL WATER SOLUBLE METAL WORKING FLUIDS Solutia Inc. (US) 2000-02-16 EP claimed
WO-1999057207-A2 METHOD FOR ELIMINATING WRINKLING IN COMPOSITE COLOR-PLUS-CLEAR COATINGS, AND COMPOSITIONS FOR USE THEREIN BASF CORPORATION (DE) 1999-11-11 WO claimed
WO-1998008919-A2 NOVEL WATER SOLUBLE METAL WORKING FLUIDS SOLUTIA INC. (US) 1998-03-05 WO claimed
US-5620787-A ALSO CONTAINING AN ALKOXY-GROUP CONTAINING ORGANOSILICON COMPOUND, A SURFACTANT AND WATER DOW CORNING TORAY SILICONE CO., LTD. (JP) 1997-04-15 US claimed
US-5521238-A WITH AN ALKOXY-GROUP CONTAINING ORGANOSILICON COMPOUND, SURFACTANT AND WATER; LACK OF OFFENSIVE ODOR; GOOD STORAGE STABILITY; IMPROVES FEEL OF TREATED FIBERS DOW CORNING TORAY SILICONE CO., LTD. (JP) 1996-05-28 US claimed
US-4414035-A AROMATIC HYDROCARBON-ALKARYLSULFONIC ACID SOLVENT PETROLITE CORPORATION (US) 1983-11-08 US claimed
US-4392865-A Hydrocarbon-water fuels, emulsions, slurries and other particulate mixtures LANKO, INC. (US) 1983-07-12 US claimed
EP-0043843-A4 HYDROCARBON WATER FUELS, SLURRIES AND OTHER PARTICULATE MIXTURES. LANKO INC (US) 1982-05-26 EP claimed
EP-0043843-A1 HYDROCARBON WATER FUELS, SLURRIES AND OTHER PARTICULATE MIXTURES LANKO, INC. (US) 1982-01-20 EP claimed
WO-1981002024-A1 HYDROCARBON WATER FUELS,SLURRIES AND OTHER PARTICULATE MIXTURES LANKO INC (US) 1981-07-23 WO claimed