SCHEMBL7739702

SCHEMBL7739702

CCCCCCCCc1ccccc1OCCOC(C)OC(C)S(=O)(=O)[O-].[Na+]

nearest known ligand 0.40

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 20)

geneUniProtsupporting neighboursconfidence
THRA known ✓ P10827 1/20 0.40
THRB known ✓ P10828 1/20 0.40
PPARG known ✓ P37231 2/20 0.37
LTB4R Q15722 1/20 0.40
LTB4R2 Q9NPC1 1/20 0.40
ADRB2 P07550 4/20 0.37
ADRB1 P08588 4/20 0.37
PPARA Q07869 2/20 0.37
MGLL Q99685 1/20 0.37
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.35
NR1I2 O75469 1/20 0.35
LMNA P02545 1/20 0.35
CHRM2 P08172 1/20 0.35
CYP3A4 P08684 1/20 0.35
ADRA2A P08913 1/20 0.35
OPRK1 P41145 1/20 0.35
HTR2B P41595 1/20 0.35

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 0.85 THRA (0.43) THRATHRBADRB2ADRB1PPARG
SCHEMBL7739699 0.83 THRA (0.42) THRATHRBADRB2ADRB1PPARG
SCHEMBL5147949 0.80 MEN1 (0.48) MEN1LMNACYP3A4KMT2A
Sulfuric Acid SCHEMBL11336604 0.80 THRA (0.47) LTB4RLTB4R2THRATHRBPPARG
SCHEMBL683428 0.80 THRA (0.44) LTB4RLTB4R2THRATHRBADRB2
SCHEMBL5435099 0.79 RECQL (0.50) LTB4RLTB4R2THRATHRBPPARG
SCHEMBL682068 0.79 ALOX5 (0.44) LTB4RLTB4R2THRATHRBADRB2
SCHEMBL14443346 0.78 THRA (0.47) LTB4RLTB4R2THRATHRBADRB2
SCHEMBL9724546 0.78 CA2 (0.44) THRATHRBLMNACHRM2CYP3A4
Sulfuric Acid SCHEMBL1682936 0.78 THRB (0.47) LTB4RLTB4R2THRATHRBPPARG

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 5 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
EP-0750225-A1 Method for reducing residual sensitizing dyes after development processing FUJI PHOTO FILM CO., LTD. (JP) 1996-12-27 EP disclosed