Ethyl Fumarate

Ethyl Fumarate

SCHEMBL9435698

CCOC(=O)/C=C\C(=O)[O-].[Na+]

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Ethyl Fumarate. 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
CA12 known ✓ O43570 1/20 0.43
CA1 known ✓ P00915 1/20 0.43
CA2 known ✓ P00918 1/20 0.43
THRB known ✓ P10828 1/20 0.41
HCAR2 Q8TDS4 4/20 0.61
MAPT P10636 6/20 0.46
ATM Q13315 1/20 0.45
NPSR1 Q6W5P4 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
LMNA P02545 3/20 0.41
MDM2 Q00987 1/20 0.41
ALDH1A1 P00352 4/20 0.41
TTR P02766 1/20 0.40
DPP4 P27487 1/20 0.40
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
Ethyl Fumarate SCHEMBL9435707 1.00 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL11470776 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL20594713 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL5016627 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL6440837 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL1904369 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL1904374 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL1903287 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL1905731 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL1902730 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109422837-B Polystyrene-maleic acid fatty alcohol ester sodium salt-silver nano composite material and preparation method thereof 天津大学 2020-12-29 CN claimed
CN-109422846-B Polymethyl methacrylate-maleic acid fatty alcohol ester sodium salt-silver nano composite material and preparation method thereof 天津大学 2020-12-29 CN claimed
US-5376145-A Using esters, salts amd amides of maleic or fumaric acid in aqueous solution; preventing loss of bulk COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1994-12-27 US claimed
EP-3702384-B1 MICROSPHERIC IONOMER HAVING CROSS-LINKING STRUCTURE, PREPARATION METHOD THEREFOR, APPLICATIONS THEREOF, AND PREPARATION SYSTEM THEREOF CHINA PETROLEUM & CHEM CORP (CN) 2025-05-14 EP disclosed
US-12221537-B2 Microspheric ionomer having cross-linked structure, preparation method therefor, applications thereof, and preparation system thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2025-02-11 US disclosed
US-20240270958-A1 MICROSPHERIC IONOMER HAVING CROSS-LINKED STRUCTURE, PREPARATION METHOD THEREFOR, APPLICATIONS THEREOF, AND PREPARATION SYSTEM THEREOF CHINA PETROLEUM & CHEM CORP (CN) 2024-08-15 US disclosed
US-11965089-B2 Microspheric ionomer having cross-linked structure, preparation method therefor, applications thereof, and preparation system thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2024-04-23 US disclosed
CN-111100239-B System and method for preparing crosslinked maleate ionomer microspheres 中国石油化工股份有限公司 2022-03-01 CN disclosed
CN-109705249-B Process for preparing ionomers and modifying polyethylene terephthalate 中国石油化工股份有限公司 2021-07-02 CN disclosed
US-20210179842-A1 Microspheric Ionomer Having Cross-Linked Structure, Preparation Method Therefor, Applications Thereof, and Preparation System Thereof CHINA PETROLEUM AND CHEMICAL CORPORATION (CN) 2021-06-17 US disclosed
EP-3702384-A1 MICROSPHERIC IONOMER HAVING CROSS-LINKING STRUCTURE, PREPARATION METHOD THEREFOR, APPLICATIONS THEREOF, AND PREPARATION SYSTEM THEREOF China Petroleum&Chemical Corporation (CN) 2020-09-02 EP disclosed
WO-1989001541-A1 TREATMENTS TO IMPROVE THE PROPERTIES OF KERATINOUS TEXTILES COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH OR (AU) 1989-02-23 WO disclosed
US-4306079-A Novel ester derivatives of polycarboxylic acids and process for making same LEVER BROTHERS COMPANY (US) 1981-12-15 US disclosed
US-4299773-A Ester derivatives of polycarboxylic acids and process for making same LEVER BROTHERS COMPANY (US) 1981-11-10 US disclosed
US-4275007-A β-Lactone esters LEVER BROTHERS COMPANY (US) 1981-06-23 US disclosed
US-4273935-A Salts of propene 1,1,2,3-tetracarboxylic acid LEVER BROTHERS COMPANY (US) 1981-06-16 US disclosed
US-4218381-A Novel ester derivatives of polycarboxylic acids and process for making same LEVER BROTHERS COMPANY (US) 1980-08-19 US disclosed
US-4209636-A Preparation of ester derivatives of polycarboxylic acids LEVER BROTHERS COMPANY (US) 1980-06-24 US disclosed
US-4159388-A Ester derivatives of 1-halo-1,1,2,3-propane tetracarboxylic acid LEVER BROTHERS COMPANY (US) 1979-06-26 US disclosed
US-4123458-A HALOGENATION, DEHYDROGENATION, DECARBOXYLATION LEVER BROTHERS COMPANY (US) 1978-10-31 US disclosed