SCHEMBL187912

SCHEMBL187912

O=C([O-])CC(C(=O)[O-])S(=O)(=O)O.[Na+].[Na+]

nearest known ligand 0.46

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 15)

geneUniProtsupporting neighboursconfidence
CA4 known ✓ P22748 3/20 0.46
CA2 known ✓ P00918 1/20 0.42
CA1 known ✓ P00915 1/20 0.30
CTSL P07711 1/20 0.39
TSHR P16473 3/20 0.34
CYP3A4 P08684 2/20 0.34
NFKB1 P19838 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
SLC22A16 Q86VW1 1/20 0.32
CASP1 P29466 1/20 0.32
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30
CPT2 P23786 1/20 0.30
CPT1A P50416 1/20 0.30

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
SCHEMBL28695498 1.00 CA4 (0.46) CA4CA2CTSLTSHRCYP3A4
Water SCHEMBL18893639 0.98 CA4 (0.44) CA4CA2CTSLTSHRCYP3A4
SCHEMBL29914627 0.98 CA4 (0.44) CA4CA2CTSLTSHRCYP3A4
Fluoride SCHEMBL31332593 0.98 CA4 (0.44) CA4CA2CTSLTSHRCYP3A4
Potassium Ion SCHEMBL28948988 0.98 CA4 (0.44) CA4CA2CTSLTSHRCYP3A4
SCHEMBL29240278 0.98 CA4 (0.44) CA4CA2CTSLTSHRCYP3A4
Ethylene SCHEMBL28109066 0.96 CA4 (0.43) CA4CA2CTSLTSHRCYP3A4
Formaldehyde SCHEMBL11795793 0.96 CA4 (0.43) CA4CA2CTSLTSHRCYP3A4
SCHEMBL1682880 0.95 CA4 (0.42) CA4CA2CTSLTSHRCYP3A4
SCHEMBL1860808 0.95 CA4 (0.42) CA4CA2CTSLTSHRCYP3A4

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

Appears in 17592 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122075370-A Composite hair dye and preparation method and application thereof 2026-05-26 CN claimed
CN-122075368-A Hair dye and preparation method and application thereof 2026-05-26 CN claimed
CN-122075369-A Mild hair dye and preparation method and application thereof 2026-05-26 CN claimed
EP-4743052-A1 3-HYDROXYPROPYLESTERS AS EMULSIFYING AGENTS Symrise AG (DE) 2026-05-20 EP claimed
CN-122011440-A Water-washing glove and preparation method thereof 南通强生新材料科技股份有限公司 2026-05-12 CN claimed
EP-4724767-A1 IMPROVED PROJECTILE Kore Outdoor (US) Inc. (US) 2026-04-15 EP claimed
US-20250382543-A1 DETERGANT PARTICLES CONTAINING POLYMER AND SURFACTANT PROCTER & GAMBLE (US) 2025-12-18 US claimed
US-20250382544-A1 DETERGANT PARTICLES CONTAINING POLYMER AND SURFACTANT PROCTER & GAMBLE (US) 2025-12-18 US claimed
US-20250382545-A1 DETERGANT PARTICLES CONTAINING SURFACTANT AND WATER-SOLUBLE POLYMER PROCTER & GAMBLE (US) 2025-12-18 US claimed
US-12471597-B2 Concentrated solutions of phytosterols and preparation process thereof GOWAN COMPANY, LLC (US) 2025-11-18 US claimed
US-4196092-A BIS(ALKYL)ESTER OF A SULFOSUCCINIC ACID SALT AMERICAN CYANAMID COMPANY (US) 1980-04-01 US claimed
US-4191655-A Dewatering composition BETZ LABORATORIES, INC. (US) 1980-03-04 US claimed
US-4185128-A CHLORINATED SOLVENT, POLYMER OF HYDROXY ALKYL ACRYLATE ACRYLONITRILE, ALKYL ACRYLATE AND ACRYLIC ACID; CURING THE DOW CHEMICAL COMPANY (US) 1980-01-22 US claimed
US-4156649-A Dewatering ore concentrates with branched alkyl ethoxylated alcohol BETZ LABORATORIES, INC. (US) 1979-05-29 US claimed
US-4048118-A ALKALI METAL SALT OF ORGANIC ACID, AMINE SALT OF PHYTIC ACID SHOWA DENKO K.K. (JA) 1977-09-13 US claimed
US-4030882-A Solvent dyeing compositions and a method of dyeing polyester fibers therewith EASTMAN KODAK COMPANY (US) 1977-06-21 US claimed
US-4029606-A ACYL-POLYHYDROXY CARBOXYLATE LION FAT & OIL CO., LTD. (JA) 1977-06-14 US claimed
US-4000094-A FREE-FLOWING BUILT DETERGENTS THE PROCTER & GAMBLE COMPANY (US) 1976-12-28 US claimed
US-3975514-A SODIUM CHLORIDE, ANIONIC SURFACTANT WEISZ GERALDINE FAY 1976-08-17 US claimed
US-3947400-A Emulsion polymerization of acrylate or other vinyl monomers using selected mixtures of soluble salts of certain sulfosuccinic acid half esters AMERICAN CYANAMID COMPANY (US) 1976-03-30 US claimed