SCHEMBL5490907

SCHEMBL5490907

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

nearest known ligand 0.50

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 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.50
RECQL P46063 3/20 0.45
TSHR P16473 3/20 0.45
MAPK1 P28482 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
GLA P06280 1/20 0.45
HPGD P15428 1/20 0.45
EPHX2 P34913 1/20 0.45
BLM P54132 1/20 0.45
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
RAD52 P43351 1/20 0.44
FAAH O00519 2/20 0.43
DGKA P23743 1/20 0.42
HTR2C P28335 1/20 0.42
EPHX1 P07099 1/20 0.40
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38

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
SCHEMBL8065978 1.00 NAAA (0.50) NAAARECQLTSHRMAPK1NPSR1
SCHEMBL5075106 1.00 NAAA (0.50) NAAARECQLTSHRMAPK1NPSR1
SCHEMBL2231100 1.00 NAAA (0.50) NAAARECQLTSHRMAPK1NPSR1
SCHEMBL22809 1.00 NAAA (0.50) NAAARECQLTSHRMAPK1NPSR1
SCHEMBL283124 1.00 NAAA (0.50) NAAARECQLTSHRMAPK1NPSR1
SCHEMBL8061841 1.00 NAAA (0.50) NAAARECQLTSHRMAPK1NPSR1
SCHEMBL11041621 1.00 NAAA (0.50) NAAARECQLTSHRMAPK1NPSR1
SCHEMBL1282784 1.00 NAAA (0.50) NAAARECQLTSHRMAPK1NPSR1
SCHEMBL219917 1.00 NAAA (0.50) NAAARECQLTSHRMAPK1NPSR1
SCHEMBL1146939 1.00 NAAA (0.50) NAAARECQLTSHRMAPK1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0600718-B1 Secondary battery CANON KK (JP) 2000-04-26 EP claimed
WO-2025134071-A1 MALIC AND GLUTARIC ACID BASED IONIZABLE LIPIDS SANOFI (FR) 2025-06-26 WO disclosed
EP-3543298-B1 PIGMENT PRINTING INK JET INK COMPOSITION, INK SET FOR PIGMENT PRINTING, AND INK JET RECORDING METHOD SEIKO EPSON CORP (JP) 2023-07-26 EP disclosed
US-20070180688-A1 METHOD FOR PRODUCING A LITHIUM SECONDARY BATTERY CANON KABUSHIKI KAISHA (JP) 2007-08-09 US disclosed
US-7081320-B2 High energy density secondary battery for repeated use CANON KABUSHIKI KAISHA (JP) 2006-07-25 US disclosed
US-6391492-B1 OXIDATION OF TITANIUM, VANADIUM, CHROMIUM, MANGANESE, IRON, COBALT, NICKEL OR COPPER BY REACTION TRANSITION METAL COMPOUND WITH WATER, ALCOHOL, OR HYDROXIDE; LITHIUM BATTERIES; DURABILITY CANON KABUSHIKI KAISHA (JP) 2002-05-21 US disclosed
WO-2001085104-A1 USE OF MELANINS IN COMPOSITIONS FOR REMOVING MAKE-UP FROM AND/OR CLEANSING THE SKIN AND MUCOUS MEMBRANES GHISALBERTI CARLO (BR) 2001-11-15 WO disclosed
US-6207326-B1 ANODES AND CATHODES WITH NITROGEN AND HALOGEN CANON KABUSHIKI KAISHA (JP) 2001-03-27 US disclosed
EP-0550463-B1 STABILIZED LIPOSOME PROCESS AND COMPOSITIONS CONTAINING THEM JOHNSON & SON INC S C (US) 1996-06-26 EP disclosed
US-5328628-A Surfactants as stabilizers S. C. JOHNSON & SON, INC. (US) 1994-07-12 US disclosed
EP-0550463-A4 STABILIZED LIPOSOME PROCESS AND COMPOSITIONS CONTAINING THEM 1993-10-13 EP disclosed
EP-0550463-A1 STABILIZED LIPOSOME PROCESS AND COMPOSITIONS CONTAINING THEM. JOHNSON & SON INC S C (US) 1993-07-14 EP disclosed
WO-1992004010-A1 STABILIZED LIPOSOME PROCESS AND COMPOSITIONS CONTAINING THEM S.C. JOHNSON & SON, INC. (US) 1992-03-19 WO disclosed
EP-0186147-B1 IMPROVED VINYL DISPERSION RESIN The B.F. GOODRICH Company (US) 1991-10-23 EP disclosed
EP-0186147-A2 Improved vinyl dispersion resin The B.F. GOODRICH Company (US) 1986-07-02 EP disclosed
US-4581413-A VINYL CHLORIDE POLYMER AND CROSSLINKED WATER-SWEELABLE UNSATURATED CARBOXYLIC ACID POLYNMER THE B. F. GOODRICH COMPANY (US) 1986-04-08 US disclosed
US-4292424-A COAGULATION, FILTRATION, RINSING, DRYING, AND FLUID ENERGY MILLING A LATEX OF A VINYL CHLORIDE POLYMER THE B.F. GOODRICH COMPANY (US) 1981-09-29 US disclosed
US-4289777-A Quinolonecarboxylic acid derivatives and pharmaceutical preparations thereof for treatment of an allergic disease of the respiratory tract SCHERING, AKTIENGESELLSCHAFT (DE) 1981-09-15 US disclosed