Fumaric Acid

Fumaric Acid

SCHEMBL2811329

CCCC[Sn+](CCCC)CCCC.CCCC[Sn+](CCCC)CCCC.O=C([O-])/C=C\C(=O)[O-]

nearest known ligand 0.46

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Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol

The experimentally established mechanism targets of Fumaric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.39
CES1 P23141 6/20 0.39
CES2 O00748 5/20 0.39
ATM Q13315 1/20 0.35
BBOX1 O75936 1/20 0.35
FABP3 P05413 5/20 0.35

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
Fumaric Acid SCHEMBL8327122 1.00 CA1 (0.39) CA1CES1CES2ATMBBOX1
Fumaric Acid SCHEMBL8846375 1.00 CA1 (0.39) CA1CES1CES2ATMBBOX1
Fumaric Acid SCHEMBL11053356 0.91 CA1 (0.37) CA1CES1CES2ATMBBOX1
Fumaric Acid SCHEMBL8397710 0.91 CES2 (0.43) CES1CES2FABP3
Fumaric Acid SCHEMBL8401314 0.91 CES2 (0.43) CES1CES2FABP3
Fumaric Acid SCHEMBL11053404 0.91 CA1 (0.37) CA1CES1CES2ATMBBOX1
Fumaric Acid SCHEMBL8914966 0.90 CA1 (0.33) CA1CES1CES2ATMBBOX1
Crotonic Acid SCHEMBL10669368 0.90 CA1 (0.35) CA1CES1CES2ATMBBOX1
Crotonic Acid SCHEMBL10669353 0.90 CA1 (0.35) CA1CES1CES2ATMBBOX1
Fumaric Acid SCHEMBL2808165 0.87 CA1 (0.35) CA1CES1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2391662-B1 PREPARATION OF A PYRITHIONE SALT DISPERSION USABLE IN URETHANE APPLICATIONS ARCH CHEM INC (US) 2016-08-10 EP claimed
US-8286667-B2 Prevention of bacterial adhesion irrigation conduits A.I. INNOVATIONS, N.V. (US) 2012-10-16 US claimed
EP-2391662-A1 PREPARATION OF A PYRITHIONE SALT DISPERSION USABLE IN URETHANE APPLICATIONS Arch Chemicals, Inc. (US) 2011-12-07 EP claimed
US-20100240800-A1 BIOCIDAL ELASTOMERIC COMPOSITIONS AND METHODS OF MAKING THE SAME DASH MULTI-CORP (US) 2010-09-23 US claimed
WO-2010088157-A1 PREPARATION OF A PYRITHIONE SALT DISPERSION USABLE IN URETHANE APPLICATIONS ARCH CHEMICALS, INC. (US) 2010-08-05 WO claimed
US-20100196506-A1 Preparation of a pyrithione salt dispersion usable in urethane applications ARCH CHEMICALS, INC. 2010-08-05 US claimed
US-20090250137-A1 Low friction lining for drip irrigation conduits CAST ENVIRONMENTAL SOLUTIONS, LLC 2009-10-08 US claimed
US-20070209144-A1 VACUUM CLEANER WITH IMPROVED HYGENIC PERFORMANCE BISSELL HOMECARE, INC. (US) 2007-09-13 US claimed
US-20060067989-A1 Degradable Animal Chewing Article Possessing Enhanced Safety, Durability, and Mouth-Feel DENESUK MATTHEW 2006-03-30 US claimed
US-6972133-B1 Degradable animal chewing article possessing enhanced safety, durability and mouth-feel SEEFAR TECHNOLOGIES, INC. (US) 2005-12-06 US claimed
US-6576246-B1 Degradable animal chewing article possessing enhanced safety, durability and mouth-feel SEEFAR TECHNOLOGIES, INC. 2003-06-10 US claimed
US-6178922-B1 Mastication article possessing microbe-inhibiting properties SEEFAR TECHNOLOGIES, INC. 2001-01-30 US claimed
EP-0685460-B1 PROCESS FOR PRODUCING HIGHER CYANOACETIC ESTER MITSUBISHI RAYON CO (JP) 1999-06-09 EP claimed
US-5902871-A USING A TRIORGANOTIN CATALYST FOR REACTING AT A TEMPERATURE BELOW 150 DEGREES C. A BLOCKED ISOCYANATE OR ISOCYANATE AND AN EPOXY; ELECTROLYTICALLY DEPOSITED COATINGS; NONTOXIC; KINETICS ELF ATOCHEM NORTH AMERICA, INC. (US) 1999-05-11 US claimed
US-5880178-A CONDUCTIVE COATINGS TRIORGANOTIN CATALYST ELF ATOCHEM NORTH AMERICA, INC. (US) 1999-03-09 US claimed
US-5698730-A TRANSESTERIFICATION REACTION OF CYANOACETIC ACID ESTER WITH ALCOHOL IN THE PRESENCE OF ORGANOTIN CATALYST NITTO CHEMICAL INDUSTRY CO., LTD. (JP) 1997-12-16 US claimed
EP-0685460-A1 PROCESS FOR PRODUCING HIGHER CYANOACETIC ESTER NITTO CHEMICAL INDUSTRY CO., LTD. (JP) 1995-12-06 EP claimed
US-4560716-A Rust preventing epoxy resin compositions KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 1985-12-24 US claimed
US-4552907-A LANOLIN, CORROSION RESISTANCE KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 1985-11-12 US claimed
US-4270953-A STORAGE STABILITY KANSAI PAINT CO., LTD. (JP) 1981-06-02 US claimed