SCHEMBL2957022

SCHEMBL2957022

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

nearest known ligand 0.39

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 7)

geneUniProtsupporting neighboursconfidence
CA1 known ✓ P00915 1/20 0.37
CA2 known ✓ P00918 1/20 0.35
CES2 O00748 6/20 0.39
GPR84 Q9NQS5 1/20 0.36
CES1 P23141 4/20 0.35
FAAH O00519 3/20 0.35
EPHX1 P07099 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
SCHEMBL1552115 1.00 CES2 (0.39) CES2CA1GPR84CA2CES1
SCHEMBL28919474 1.00 CES2 (0.39) CES2CA1GPR84CA2CES1
SCHEMBL7967481 1.00 CES2 (0.39) CES2CA1GPR84CA2CES1
SCHEMBL2729135 1.00 CES2 (0.39) CES2CA1GPR84CA2CES1
SCHEMBL11432185 1.00 CES2 (0.39) CES2CA1GPR84CA2CES1
SCHEMBL10993074 1.00 CES2 (0.39) CES2CA1GPR84CA2CES1
SCHEMBL339202 1.00 CES2 (0.39) CES2CA1GPR84CA2CES1
SCHEMBL219970 1.00 CES2 (0.39) CES2CA1GPR84CA2CES1
SCHEMBL1666274 1.00 CES2 (0.39) CES2CA1GPR84CA2CES1
SCHEMBL9651109 1.00 CES2 (0.39) CES2CA1GPR84CA2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7758684-B2 Ink additive and ink using same NISSIN CHEMICAL INDUSTRY CO., LTD. (JP) 2010-07-20 US claimed
US-20070283845-A1 Ink additive and ink using same NISSIN CHEMICAL INDUSTRY CO., LTD. (JP) 2007-12-13 US claimed
US-8632881-B2 Glass fiber product NISSIN CHEMICAL INDUSTRY CO., LTD. (JP) 2014-01-21 US disclosed
US-7758684-B2 Ink additive and ink using same NISSIN CHEMICAL INDUSTRY CO., LTD. (JP) 2010-07-20 US disclosed
US-20090136764-A1 GLASS FIBER PRODUCT MIZUSAKI TORU 2009-05-28 US disclosed
EP-1897924-B1 Protective coating containing acetylene compound NISSIN CHEMICAL IND (JP) 2009-05-06 EP disclosed
US-20080063852-A1 Protective coating containing acetylene compound NISSIN CHEMICAL INDUSTRY CO., LTD. (JP) 2008-03-13 US disclosed
EP-1897924-A1 Protective coating containing acetylene compound Nissin Chemical Industry Co., Ltd. (JP) 2008-03-12 EP disclosed
US-20070283845-A1 Ink additive and ink using same NISSIN CHEMICAL INDUSTRY CO., LTD. (JP) 2007-12-13 US disclosed
EP-1059562-B1 Method for processing a silver halide light sensitive photographic material KONISHIROKU PHOTO IND (JP) 2003-09-17 EP disclosed
US-6479199-B2 CONTAINING CYANINE DYE KONICA CORPORATION (JP) 2002-11-12 US disclosed
US-6440652-B1 ASCORBIC ACID AND DERIVATIVES AS DEVELOPER; SUPERIOR REPRODUCIBILITY OF ORIGINALS WITH GOOD CONTRAST, SENSITIVITY, AND LESS SILVER SLUDGE EVEN AT LOW REPLENISHING RATE OR AMOUNTS; ACYLHYDRAZINE COMPOUNDS KONICA CORPORATION (JP) 2002-08-27 US disclosed
EP-1059562-A1 Method for processing a silver halide light sensitive photographic material KONICA CORPORATION (JP) 2000-12-13 EP disclosed
EP-0930534-A1 A black-white image forming method KONICA CORPORATION (JP) 1999-07-21 EP disclosed