SCHEMBL9158995

SCHEMBL9158995

COCCOCCOS(=O)(=O)[O-].[Na+]

nearest known ligand 0.47

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 8)

geneUniProtsupporting neighboursconfidence
CA2 known ✓ P00918 1/20 0.42
RECQL P46063 2/20 0.47
GLA P06280 1/20 0.47
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
EPHX2 P34913 1/20 0.47
BLM P54132 1/20 0.47

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
SCHEMBL9155283 0.93 TSHR (0.52) RECQLGLAHPGDTSHRMAPK1
Lithium Ion SCHEMBL17456556 0.88 TSHR (0.46) RECQLGLAHPGDTSHRMAPK1
SCHEMBL30227863 0.88 RECQL (0.50) RECQLGLAHPGDTSHRMAPK1
SCHEMBL30187610 0.86 RECQL (0.40) RECQLGLAHPGDTSHRMAPK1
Lithium Ion SCHEMBL17456609 0.83 RECQL (0.44) RECQLGLAHPGDTSHRMAPK1
SCHEMBL9580677 0.82 RECQL (0.52) RECQLGLAHPGDTSHRMAPK1
Sulfuric Acid SCHEMBL28778945 0.80 CA2 (0.48) HPGDTSHRCA2
SCHEMBL2750421 0.80 TSHR (0.56) RECQLGLAHPGDTSHRMAPK1
SCHEMBL15475636 0.79 RECQL (0.54) RECQLGLAHPGDTSHRMAPK1
SCHEMBL6817543 0.78 TSHR (0.64) RECQLGLAHPGDTSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10166755-B2 Planographic printing plate precursor, method of producing same, and printing method using same FUJIFILM CORPORATION (JP) 2019-01-01 US disclosed
CN-106715139-B Original edition of lithographic printing plate, the manufacturing method of Driginal plate of plate-printing board and the printing process using original edition of lithographic printing plate 富士胶片株式会社 2018-12-11 CN disclosed
EP-3202586-B1 LITHOGRAPHIC PRINTING PLATE MASTER, MANUFACTURING METHOD THEREFOR, AND PRINTING METHOD USING SAME FUJIFILM CORP (JP) 2018-11-28 EP disclosed
EP-3202586-A1 LITHOGRAPHIC PRINTING PLATE MASTER, MANUFACTURING METHOD THEREFOR, AND PRINTING METHOD USING SAME Fujifilm Corporation (JP) 2017-08-09 EP disclosed
US-20170197400-A1 PLANOGRAPHIC PRINTING PLATE PRECURSOR, METHOD OF PRODUCING SAME, AND PRINTING METHOD USING SAME FUJIFILM CORPORATION (JP) 2017-07-13 US disclosed
CN-106715139-A Lithographic printing plate master, manufacturing method therefor, and printing method using same 富士胶片株式会社 2017-05-24 CN disclosed
EP-0539370-B1 PROCESS FOR SULFATING UNSATURATED ALCOHOLS PROCTER & GAMBLE (US) 1995-02-01 EP disclosed
WO-1991013057-A1 CO-SULFATION OF ETHOXYLATED ALCOHOLS AND UNSATURATED FATTY ALCOHOLS THE PROCTER & GAMBLE COMPANY (US) 1991-09-05 WO disclosed
US-5037992-A Process for sulfating unsaturated alcohols THE PROCTER & GAMBLE COMPANY (US) 1991-08-06 US disclosed