SCHEMBL7560266

SCHEMBL7560266

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

nearest known ligand 0.58

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
NAAA Q02083 1/20 0.58
TSHR P16473 4/20 0.52
RECQL P46063 2/20 0.52
GLA P06280 1/20 0.52
HPGD P15428 1/20 0.52
MAPK1 P28482 1/20 0.52
EPHX2 P34913 1/20 0.52
BLM P54132 1/20 0.52
RAD52 P43351 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
FAAH O00519 2/20 0.49
DGKA P23743 1/20 0.48
HTR2C P28335 1/20 0.47
EPHX1 P07099 1/20 0.46
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
HCAR2 Q8TDS4 1/20 0.42
DNM1 Q05193 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL11701087 1.00 NAAA (0.58) NAAATSHRRECQLGLAHPGD
SCHEMBL11699296 1.00 NAAA (0.58) NAAATSHRRECQLGLAHPGD
SCHEMBL121777 1.00 NAAA (0.58) NAAATSHRRECQLGLAHPGD
SCHEMBL8423143 1.00 NAAA (0.58) NAAATSHRRECQLGLAHPGD
SCHEMBL6839071 1.00 NAAA (0.58) NAAATSHRRECQLGLAHPGD
Potassium Ion SCHEMBL6116073 0.96 NAAA (0.58) NAAATSHRRECQLGLAHPGD
Potassium Ion SCHEMBL6116219 0.96 NAAA (0.58) NAAATSHRRECQLGLAHPGD
Stearic Acid SCHEMBL5324257 0.91 NAAA (0.49) NAAATSHRRECQLGLAHPGD
SCHEMBL11699136 0.91 FAAH (0.56) NAAAEPHX2FAAHALDH1A1
SCHEMBL1020488 0.85 NAAA (0.43) NAAATSHRRECQLGLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020015925-A1 Image forming material KONICA CORPORATION (JP) 2002-02-07 US disclosed
US-4246154-A COMPRISING AN AQUEOUS DISPERSION OF HYDROPHOBIC DYE AND VINYL POLYMER FUJI PHOTO FILM CO., LTD. (JP) 1981-01-20 US disclosed