SCHEMBL2167668

SCHEMBL2167668

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

nearest known ligand 0.00

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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 SCHEMBL28700682 0.97 CA4 (0.44)
SCHEMBL31560796 0.93 CASP1 (0.30)
Potassium Ion SCHEMBL4855093 0.93
SCHEMBL4850698 0.93 CASP1 (0.30)
SCHEMBL4851288 0.93 CASP1 (0.30)
SCHEMBL31693522 0.86
SCHEMBL28610481 0.83 CA4 (0.35)
SCHEMBL4856888 0.78 CASP1 (0.32)
Tribromoacetic Acid SCHEMBL2079154 0.78 CA4 (0.39)
SCHEMBL4853842 0.78 CASP1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025096782-A1 FLUORINATED CANNABINOID COMPOSITIONS AND METHODS THEREOF COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2025-05-08 WO claimed
CN-119661449-A Preparation method of 5- (difluoromethoxy) pyrazine-2-amine 无锡捷化医药科技有限公司 2025-03-21 CN claimed
US-20220162227-A1 METHODS FOR THE PREPARATION OF 1,3-BENZODIOXOLE HETEROCYCLIC COMPOUNDS UNION therapeutics A/S (DK) 2022-05-26 US claimed
EP-4027995-B1 HPK1 ANTAGONISTS AND USES THEREOF NIMBUS SATURN INC (US) 2026-05-27 EP disclosed
CN-122094943-A Novel 1,2, 4-oxadiazoles as fungicides 2026-05-26 CN disclosed
US-20260138956-A1 NOVEL COMPOUNDS AND USES THEREOF RECURSION PHARMACEUTICALS INC (US) 2026-05-21 US disclosed
US-12610949-B2 Heteroaryl-triazole compounds as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2026-04-28 US disclosed
US-20260109715-A1 IMIDAZOPYRIDINE DERIVATIVES WITH BICYCLIC STRUCTURE PUBLIC UNIVERSITY CORPORATION YOKOHAMA CITY UNIVERSITY (JP) 2026-04-23 US disclosed
EP-4688154-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - Portela & Ca., S.A. (PT) 2026-02-11 EP disclosed
US-20260035341-A1 FTO INHIBITORS RPXDS CO LTD (CN) 2026-02-05 US disclosed
US-20260027113-A1 PHTHALAZINONE BASED MODULATORS FOR THE TREATMENT OF DISEASE SOLEY THERAPEUTICS INC (US) 2026-01-29 US disclosed
EP-2522648-A1 PROCESS FOR PRODUCING DIFLUOROCYCLOPROPANE COMPOUND Central Glass Company, Limited (JP) 2012-11-14 EP disclosed
EP-2519508-A2 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals, Inc. (US) 2012-11-07 EP disclosed
US-20120277458-A1 METHOD FOR PRODUCING DIFLUOROCYCLOPROPANE COMPOUND CENTRAL GLASS COMPANY, LIMITED (JP) 2012-11-01 US disclosed
US-20120277458-A1 METHOD FOR PRODUCING DIFLUOROCYCLOPROPANE COMPOUND CENTRAL GLASS COMPANY, LIMITED (JP) 2012-11-01 US disclosed
JP-2011140474-A METHOD FOR PRODUCING DIFLUOROCYCLOPROPANE COMPOUND CENTRAL GLASS CO LTD 2011-07-21 JP disclosed
WO-2011083612-A1 PROCESS FOR PRODUCING DIFLUOROCYCLOPROPANE COMPOUND セントラル硝子株式会社 (JP) 2011-07-14 WO disclosed
WO-2011082245-A2 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2011-07-07 WO 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