SCHEMBL6725199

SCHEMBL6725199

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

nearest known ligand 0.30

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 1)

geneUniProtsupporting neighboursconfidence
CA4 known ✓ P22748 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
SCHEMBL892910 0.84 USP2 (0.30)
SCHEMBL5946667 0.77 CA4 (0.34) CA4
SCHEMBL7513032 0.77 ALDH1A1 (0.32)
SCHEMBL4539299 0.71
SCHEMBL892908 0.71
SCHEMBL893127 0.70 USP2 (0.31)
SCHEMBL6899580 0.68 CA4 (0.40) CA4
SCHEMBL2441480 0.67 CA2 (0.38) CA4
SCHEMBL5385256 0.65 USP2 (0.33)
Lithium Ion SCHEMBL5013299 0.64 CA4 (0.35) CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6677112-B2 CONTAINING COMPOUND A (MERCAPTO TETRAZOLE COMPOUND) HAVING ADSORPTIVITY TO SILVER, CONTENT OF COMPOUND A IN THE SHELL IS SMALLER THAN THE CONTENT OF COMPOUND A IN THE CORE KONICA CORPORATION (JP) 2004-01-13 US disclosed
US-20030203328-A1 Silver halide emulsion, preparation method of silver halide emulsion, silver halide light-sensitive photographic material, silver halide light-sensitive color photographic material, and image forming method KONICA CORPORATION (JP) 2003-10-30 US disclosed
EP-1327907-A2 Silver halide emulsion, preparation method of silver halide emulsion, silver halide light-sensitive photographic material, silver halide light-sensitive color photographic material, and image forming method KONICA CORPORATION (JP) 2003-07-16 EP disclosed