SCHEMBL344783

SCHEMBL344783

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

nearest known ligand 0.50

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 4)

geneUniProtsupporting neighboursconfidence
CA4 known ✓ P22748 3/20 0.33
CA1 known ✓ P00915 1/20 0.30
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
Potassium Ion SCHEMBL4846797 0.94 CA4 (0.35) CA4FAHD1
SCHEMBL4850852 0.94
SCHEMBL4853875 0.94
SCHEMBL6119631 0.78
SCHEMBL68124 0.78
SCHEMBL4854298 0.77 CA4 (0.33) CA4CASP1FAHD1CA1
SCHEMBL28716379 0.73
SCHEMBL4855381 0.71 CA4 (0.33) CA4CASP1
SCHEMBL4848010 0.71 CA4 (0.33) CA4CASP1
SCHEMBL3081427 0.71 ALDH1A1 (0.33)

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2857390-B1 Method for producing hexafluoropropylene oxide DAIKIN IND LTD (JP) 2017-12-06 EP disclosed
US-9169225-B2 Method for producing hexafluoropropylene oxide DAIKIN INDUSTRIES, LTD. (JP) 2015-10-27 US disclosed
EP-2857390-A1 Method for producing hexafluoropropylene oxide DAIKIN INDUSTRIES, LIMITED (JP) 2015-04-08 EP disclosed
EP-2409970-B1 METHOD FOR PRODUCING HEXAFLUOROPROPYLENE OXIDE DAIKIN IND LTD (JP) 2014-12-17 EP disclosed
EP-2409970-A1 METHOD FOR PRODUCING HEXAFLUOROPROPYLENE OXIDE Daikin Industries, Ltd. (JP) 2012-01-25 EP disclosed
US-20120016142-A1 METHOD FOR PRODUCING HEXAFLUOROPROPYLENE OXIDE DAIKIN INDUSTRIES, LTD. (JP) 2012-01-19 US disclosed
US-7414148-B2 Process for producing alkoxycarbonylfluoroalkanesulfonates CENTRAL GLASS COMPANY LIMITED (JP) 2008-08-19 US disclosed
US-20080108846-A1 PROCESS FOR PRODUCING ALKOXYCARBONYLFLUOROALKANESULFONATES CENTRAL GLASS COMPANY, LIMITED (JP) 2008-05-08 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-20080108846-A1 PROCESS FOR PRODUCING ALKOXYCARBONYLFLUOROALKANESULFONATES ARSA, PFAS, MPST CA4 112/4885CA1 462/4885CASP1 2376/4885
US-20120016142-A1 METHOD FOR PRODUCING HEXAFLUOROPROPYLENE OXIDE PPOX, HAO2, LPO CA4 1785/4885CA1 662/4885CASP1 2243/4885

“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.