SCHEMBL7739699

SCHEMBL7739699

CCCCCCCCc1ccccc1OC(C)OC(C)OC(C)S(=O)(=O)[O-].[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 15)

geneUniProtsupporting neighboursconfidence
THRA known ✓ P10827 1/20 0.42
THRB known ✓ P10828 1/20 0.42
PPARG known ✓ P37231 1/20 0.39
CYSLTR1 known ✓ Q9Y271 2/20 0.36
ALOX5 known ✓ P09917 1/20 0.36
PTGS2 known ✓ P35354 1/20 0.36
PPARA Q07869 2/20 0.39
CYSLTR2 Q9NS75 2/20 0.36
LIPG Q9Y5X9 1/20 0.36
FUT7 Q11130 1/20 0.34
ADRB2 P07550 4/20 0.34
ADRB1 P08588 4/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
MGLL Q99685 1/20 0.34

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
SCHEMBL2234780 0.98 THRA (0.43) THRATHRBPPARAPPARGCYSLTR2
SCHEMBL10698028 0.87 THRA (0.45) THRATHRBPPARAPPARGCYSLTR2
SCHEMBL8419665 0.84 THRA (0.47) THRATHRBPPARAPPARGCYSLTR2
SCHEMBL7739702 0.83 LTB4R (0.40) THRATHRBPPARAPPARGADRB2
SCHEMBL7650228 0.82 THRA (0.49) THRATHRBPPARAPPARGCYSLTR2
SCHEMBL10823275 0.81 THRA (0.43) THRATHRBPPARAPPARGCYSLTR2
SCHEMBL8445975 0.80 THRA (0.49) THRATHRBPPARAPPARGCYSLTR2
SCHEMBL330345 0.80 THRA (0.49) THRATHRBPPARAPPARGCYSLTR2
SCHEMBL5147946 0.79 FUT7 (0.44) THRATHRBPPARAPTGS2FUT7
SCHEMBL8708162 0.78 THRA (0.45) THRATHRBPPARAPPARGCYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6496280-B2 Method for image formation and apparatus for development processing FUJI PHOTO FILM CO., LTD. (JP) 2002-12-17 US disclosed
US-20010022663-A1 Method for image formation and apparatus for development processing FUJIFILM CORPORATION (JP) 2001-09-20 US disclosed
US-6207360-B1 FIXING-OMITTED DEVELOPMENT PROCESSING, DESILVERING-OMITTED DEVELOPMENT PROCESSING OR BLEACHING-OMITTED DEVELOPMENT PROCESSING FUJI PHOTO FILM CO., LTD. (JP) 2001-03-27 US disclosed
EP-0750225-B1 Use of hydroxamic acid derivatives for reducing the amount of residual sensitizing dyes after development processing FUJI PHOTO FILM CO LTD (JP) 2000-10-04 EP disclosed
US-5630927-A DEVELOPMENT INHIBITOR RELEASING COUPLERS, COLOR FILMS, IMPROVED SHARPNESS, GRAININESS, STORAGE STABILITY, COLOR REPRODUCIBILITY FUJI PHOTO FILM CO., LTD. (JP) 1997-05-20 US disclosed
EP-0750225-A1 Method for reducing residual sensitizing dyes after development processing FUJI PHOTO FILM CO., LTD. (JP) 1996-12-27 EP disclosed