SCHEMBL1039798

SCHEMBL1039798

Cc1ccc(C(=O)OS(=O)(=O)O)c(C)c1C(=O)[O-].[Na+]

nearest known ligand 0.30

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 1)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 1/20 0.30

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
SCHEMBL743208 0.87 ALDH1A1 (0.30) FFAR4
SCHEMBL743209 0.84 METAP2 (0.34) —
SCHEMBL8758348 0.78 KDM4E (0.38) —
SCHEMBL9450649 0.76 METAP2 (0.35) FFAR4
SCHEMBL2470723 0.75 TSHR (0.40) —
SCHEMBL271088 0.74 CYP1A2 (0.37) —
SCHEMBL3341067 0.72 FFAR4 (0.40) FFAR4
SCHEMBL29118742 0.70 ALDH1A1 (0.47) —
SCHEMBL29178432 0.70 ALDH1A1 (0.42) —
SCHEMBL8879074 0.69 KDM4E (0.39) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1318176-B1 Color enhancement for resin blends SABIC INNOVATIVE PLASTICS IP (NL) 2011-01-26 — — EP disclosed
EP-1299582-B1 A PROCESS TO PREPARE MELT-COLORED POLYMERIC FIBERS SABIC INNOVATIVE PLASTICS IP (NL) 2008-10-08 — — EP disclosed
EP-0897947-B2 Fine cell-containing polyester film MITSUBISHI POLYESTER FILM CORP (JP) 2005-12-28 — — EP disclosed
US-20030146536-A1 Color enhancement for resin blends GENERAL ELECTRIC COMPANY 2003-08-07 — — US disclosed
US-20030129398-A1 Process to prepare polymeric fibers with improved color and appearance GENERAL ELECTRIC COMPANY 2003-07-10 — — US disclosed
EP-1318176-A1 Color enhancement for resin blends GENERAL ELECTRIC COMPANY (US) 2003-06-11 — — EP disclosed
EP-1299582-A1 A PROCESS TO PREPARE MELT-COLORED POLYMERIC FIBERS GENERAL ELECTRIC COMPANY (US) 2003-04-09 — — EP disclosed
US-6495079-B1 MELT BLENDING POLYAMIDE OR POLYESTER RESIN, COLORANT AND WATER INSOLUBLE ALKYLENE ARYL POLYESTER SULFONATE SALT COPOLYMER HAVING METAL SULFONATE UNITS, FORMING INTO FILAMENTS, DRAWING INTO FIBERS HAVING IMPROVED COLOR STRENGTH PRISMA FIBERS, INC. 2002-12-17 — — US disclosed
EP-0897947-B1 Fine cell-containing polyester film MITSUBISHI POLYESTER FILM CORP (JP) 2002-03-27 — — EP disclosed
WO-2002000974-A1 PROCESS TO PREPARE MELT-COLORED POLYMERIC FIBERS GENERAL ELECTRIC COMPANY (US) 2002-01-03 — — WO disclosed
US-6130278-A GLOSS, PRINTABILITY, TRANSPORT PROPERTY AND/OR FLEXIBILITY; IMAGE-RECEIVING PAPERS SUITABLE FOR VIDEO PRINTER, RELEASE PAPERS MITSUBISHI POLYSTER FILM CORPORATION (JP) 2000-10-10 — — US disclosed
EP-0897947-A2 Fine cell-containing polyester film Mitsubishi Polyester Film Corporation (JP) 1999-02-24 — — EP disclosed
EP-0159283-B1 POLYESTER COMPOSITION THE GOODYEAR TIRE & RUBBER COMPANY (US) 1990-09-12 — — EP disclosed
EP-0103531-B1 POLYETHYLENE ISOPHTHALATE HAVING REDUCED CYCLIC DIMER CONTENT AND PROCESS THEREFOR THE GOODYEAR TIRE & RUBBER COMPANY (US) 1986-12-30 — — EP disclosed
US-4585854-A Polyester composition THE GOODYEAR TIRE & RUBBER COMPANY (US) 1986-04-29 — — US disclosed
EP-0159283-A2 Polyester composition THE GOODYEAR TIRE & RUBBER COMPANY (US) 1985-10-23 — — EP disclosed
US-4525524-A Polyester composition THE GOODYEAR TIRE & RUBBER COMPANY (US) 1985-06-25 — — US disclosed
EP-0103531-A1 Polyethylene isophthalate having reduced cyclic dimer content and process therefor THE GOODYEAR TIRE & RUBBER COMPANY (US) 1984-03-21 — — EP disclosed
US-4418188-A PROTONIC ACID CATALYSTS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1983-11-29 — — US disclosed
US-4104262-A LACQUER BINDING AGENTS DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) 1978-08-01 — — US disclosed
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