SCHEMBL8022640

SCHEMBL8022640

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

nearest known ligand 0.56

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 18)

geneUniProtsupporting neighboursconfidence
CA2 known ✓ P00918 2/20 0.56
CA1 known ✓ P00915 2/20 0.53
GPR84 Q9NQS5 6/20 0.47
NFKB1 P19838 3/20 0.45
CYP3A4 P08684 2/20 0.45
TSHR P16473 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
TP53 P04637 1/20 0.44
FFAR1 O14842 1/20 0.41
MAPT P10636 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
MMP9 P14780 2/20 0.40
MMP13 P45452 2/20 0.40
ADAM17 P78536 2/20 0.40
MMP1 P03956 1/20 0.40

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
SCHEMBL30424973 1.00 CA2 (0.56) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL3932122 1.00 CA2 (0.56) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL26969246 1.00 CA2 (0.56) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL247523 1.00 CA2 (0.56) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL2123672 1.00 CA2 (0.56) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL66700 1.00 CA2 (0.56) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL11699305 1.00 CA2 (0.56) CA2CA1GPR84NFKB1CYP3A4
Potassium Ion SCHEMBL1133718 0.96 CA2 (0.52) CA2CA1GPR84NFKB1CYP3A4
Potassium Ion SCHEMBL1133667 0.96 CA2 (0.52) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL5167672 0.89 ZDHHC7 (0.47) CA2CA1GPR84NFKB1CYP3A4

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108727233-B Dry forming process and device for improving low-temperature solubility of alpha-sodium methyl sulfopalmitate 赞宇科技集团股份有限公司 2024-02-27 CN claimed
US-10758468-B2 Solubilizer for cosmetic preparations SYMRISE AG (DE) 2020-09-01 US claimed
EP-0765306-B1 ALKYL SULFOACETATE COMPOSITIONS AND METHODS FOR PREPARING SAME STEPAN CO (US) 1999-10-20 EP claimed
EP-0765306-A1 ALKYL SULFOACETATE COMPOSITIONS AND METHODS FOR PREPARING SAME STEPAN COMPANY (US) 1997-04-02 EP claimed
WO-1995034532-A1 ALKYL SULFOACETATE COMPOSITIONS AND METHODS FOR PREPARING SAME STEPAN COMPANY (US) 1995-12-21 WO claimed
EP-4620453-A1 AQUEOUS DISPERSION OF SURFACE-HYDROPHOBIZED INORGANIC POWDER AND COSMETIC PREPARATION CONTAINING SAME Nikko Chemicals Co., Ltd. (JP) 2025-09-24 EP disclosed
CN-119997951-A Method for preventing, alleviating and/or treating PTGS 2-induced skin disorders and related dysfunctions 西姆莱斯股份公司 2025-05-13 CN disclosed
CN-114728092-B Edge block with improved odor performance 西姆莱斯股份公司 2025-02-28 CN disclosed
CN-118922168-A Sun cream additive 西姆莱斯股份公司 2024-11-08 CN disclosed
CN-118891030-A Hair care compositions 西姆莱斯股份公司 2024-11-01 CN disclosed
CN-118829416-A Composition (III) 西姆莱斯股份公司 2024-10-22 CN disclosed
CN-118159632-A Perfume and perfume mixture 西姆莱斯股份公司 2024-06-07 CN disclosed
US-8834857-B1 Deodorizing and skin cleaning NEVADA NATURALS INC. (US) 2014-09-16 US disclosed
EP-0631611-B1 NEUTRAL pH CLEANSING BAR PROCTER & GAMBLE (US) 2000-02-02 EP disclosed
EP-0631614-B1 SKIN pH CLEANSING BAR PROCTER & GAMBLE (US) 1999-06-09 EP disclosed
EP-0559837-B1 SHAPED SOLID MADE WITH A RIGID, INTERLOCKING MESH OF NEUTRALIZED CARBOXYLIC ACID PROCTER & GAMBLE (US) 1995-10-25 EP disclosed
EP-0631611-A1 NEUTRAL pH CLEANSING BAR THE PROCTER & GAMBLE COMPANY (US) 1995-01-04 EP disclosed
EP-0631614-A1 SKIN pH CLEANSING BAR THE PROCTER & GAMBLE COMPANY (US) 1995-01-04 EP disclosed
WO-1993019154-A1 NEUTRAL pH CLEANSING BAR THE PROCTER & GAMBLE COMPANY (US) 1993-09-30 WO disclosed
WO-1993019159-A1 SKIN PH CLEANSING BAR THE PROCTER & GAMBLE COMPANY (US) 1993-09-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10758468-B2 Solubilizer for cosmetic preparations SRPK3, SRPK1, SYMPK CA2 613/4885CA1 2900/4885GPR84 3040/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.