SCHEMBL789396

SCHEMBL789396

O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.[Na+]

nearest known ligand 0.42

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 11)

geneUniProtsupporting neighboursconfidence
THRB known ✓ P10828 1/20 0.42
CA1 known ✓ P00915 3/20 0.32
CA2 known ✓ P00918 2/20 0.32
CA4 known ✓ P22748 2/20 0.32
MMP1 P03956 2/20 0.32
MMP2 P08253 2/20 0.32
MMP9 P14780 2/20 0.32
MMP8 P22894 2/20 0.32
MMP13 P45452 2/20 0.32
CASP1 P29466 1/20 0.32
FAHD1 Q6P587 1/20 0.32

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
Silver SCHEMBL623539 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
Potassium Ion SCHEMBL6269201 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL4576505 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL4580568 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL22598032 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
Zinc Ion SCHEMBL4582401 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL10694663 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL19179127 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
Lithium Ion SCHEMBL21069099 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2
SCHEMBL28573082 0.94 THRB (0.42) THRBCA1CA2MMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119612707-A Method for degrading organic matters by electrochemical lithium extraction coupling electrooxidation of water produced by oil and gas field 中国石油大学(北京) 2025-03-14 CN claimed
CN-113998704-A Silica nanoparticles, method for the production thereof, use thereof, composite and use thereof 上海唯可生物科技有限公司 2022-02-01 CN claimed
CN-113787802-A PET (polyethylene terephthalate) film for solar cell back panel and preparation method thereof 宁波勤邦新材料科技有限公司 2021-12-14 CN claimed
US-9200118-B2 Quaternised polybenzimidazole COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-12-01 US claimed
EP-2616499-B1 QUATERNISED POLYBENZIMIDAZOLE COUNCIL SCIENT IND RES (IN) 2015-03-11 EP claimed
EP-2616499-A1 QUATERNISED POLYBENZIMIDAZOLE Council of Scientific & Industrial Research (IN) 2013-07-24 EP claimed
US-20130184412-A1 QUATERNISED POLYBENZIMIDAZOLE COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2013-07-18 US claimed
WO-2012035556-A1 QUATERNISED POLYBENZIMIDAZOLE COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2012-03-22 WO claimed
US-20080312339-A1 FLUORINE-SUBSTITUTED ALKYL PHENOL COMPOUNDS AND THEIR USES BAKER MAX T 2008-12-18 US claimed
US-20030194378-A1 Novel aerosol formulation containing a polar fluorinated molecule ASTRAZENECA AB (SE) 2003-10-16 US claimed
WO-2003077894-A1 FLUORINE-SUBSTITUTED ALKYL PHENOL COMPOUNDS AND THEIR USES UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2003-09-25 WO claimed
US-20030176513-A1 Fluorine-substituted alkyl phenol compounds and their uses IOWA RESEARCH FOUNDATION, UNIVERSITY OF 2003-09-18 US claimed
EP-1303258-A1 NOVEL AEROSOL FORMULATION CONTAINING A POLAR FLUORINATED MOLECULE AstraZeneca AB (SE) 2003-04-23 EP claimed
WO-2002003958-A1 NOVEL AEROSOL FORMULATION CONTAINING A POLAR FLUORINATED MOLECULE ASTRAZENECA AB (SE) 2002-01-17 WO claimed
WO-2026102095-A1 METHODS FOR DETECTING PER- OR POLY-FLUOROALKYL SUBSTANCES WITH FLUOROPHORES UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2026-05-15 WO disclosed
EP-4657572-A1 COMPOSITION, ELECTROCHEMICAL DEVICE BINDER, ELECTRODE MIXTURE, ELECTRODE, AND SECONDARY BATTERY Daikin Industries, Ltd. (JP) 2025-12-03 EP disclosed
US-20250349897-A1 ELECTROLYTIC SOLUTION, AND ELECTROCHEMICAL DEVICE AND SECONDARY BATTERY USING SAME DAIKIN INDUSTRIES, LTD. (JP) 2025-11-13 US disclosed
US-4562275-A ANTICARCINOGENIC AGENTS BRISTOL-MYERS CO. (US) 1985-12-31 US disclosed
US-4010212-A REFRIGERANTS, SOLVENTS, DIELECTRIC OR INSULATING FLUIDS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1977-03-01 US disclosed
US-3981928-A Perfluorotertiaryalkyl ethers MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1976-09-21 US 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 (2 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-20030176513-A1 Fluorine-substituted alkyl phenol compounds and their uses AFF4, AFF1, AFF2 THRB 3491/4885CA1 3712/4885CA2 2598/4885
US-20080312339-A1 FLUORINE-SUBSTITUTED ALKYL PHENOL COMPOUNDS AND THEIR USES AFF4, AFF1, AFF2 THRB 3491/4885CA1 3712/4885CA2 2598/4885

“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.