SCHEMBL9854727

SCHEMBL9854727

CCCCCOCC(O)CS(=O)(=O)[O-].[Na+]

nearest known ligand 0.54

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
USP2 O75604 1/20 0.54
HTT P42858 1/20 0.53
LPAR5 Q9H1C0 4/20 0.50
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C19 P33261 1/20 0.47
RECQL P46063 2/20 0.44
GLA P06280 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
EPHX2 P34913 1/20 0.44
BLM P54132 1/20 0.44
SPHK1 Q9NYA1 1/20 0.41
PLA2G2C Q5R387 3/20 0.40
LPAR1 Q92633 5/20 0.39
LPAR3 Q9UBY5 5/20 0.39
HSD17B10 Q99714 1/20 0.37
CES2 O00748 1/20 0.37
LPAR6 P43657 3/20 0.36

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
SCHEMBL31579157 0.98 USP2 (0.57) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL4428413 0.98 USP2 (0.57) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL9615620 0.87 USP2 (0.49) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL27614722 0.83 USP2 (0.62) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL3813244 0.83 USP2 (0.58) USP2HTTLPAR5CYP1A2CYP3A4
Sulfuric Acid SCHEMBL11758023 0.82 USP2 (0.77) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL6235780 0.81 USP2 (0.41) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL9854730 0.81 USP2 (0.56) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL10395669 0.81 USP2 (0.61) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL9615619 0.81 USP2 (0.46) USP2HTTLPAR5CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0439069-A2 Silver halide photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1991-07-31 EP disclosed