Fumaric Acid

Fumaric Acid

SCHEMBL384277

CCCCCC[Sn]CCCCCC.O=C(O)C=CC(=O)O

nearest known ligand 0.55

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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 8)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.53
ATG4B Q9Y4P1 11/20 0.45
PLA2G1B P04054 9/20 0.45
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
CYP1A2 P05177 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
RECQL P46063 1/20 0.45

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
Octane SCHEMBL27977732 1.00 HCAR2 (0.53) HCAR2ATG4BPLA2G1BTHRATHRB
Maleic Acid SCHEMBL27638142 1.00 HCAR2 (0.53) HCAR2ATG4BPLA2G1BTHRATHRB
Maleic Acid SCHEMBL27638152 1.00 HCAR2 (0.53) HCAR2ATG4BPLA2G1BTHRATHRB
Maleic Acid SCHEMBL900756 1.00 HCAR2 (0.53) HCAR2ATG4BPLA2G1BTHRATHRB
Fumaric Acid SCHEMBL901027 1.00 HCAR2 (0.53) HCAR2ATG4BPLA2G1BTHRATHRB
Maleic Acid SCHEMBL7532138 1.00 HCAR2 (0.53) HCAR2ATG4BPLA2G1BTHRATHRB
Maleic Acid SCHEMBL28649558 0.98 HCAR2 (0.52) HCAR2ATG4BPLA2G1BTHRATHRB
Maleic Acid SCHEMBL1274105 0.91 HCAR2 (0.50) HCAR2ATG4BPLA2G1BTHRATHRB
Maleic Acid SCHEMBL538717 0.91 HCAR2 (0.50) HCAR2ATG4BPLA2G1BTHRATHRB
Maleic Acid SCHEMBL3685225 0.91 HCAR2 (0.50) HCAR2ATG4BPLA2G1BTHRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3456746-B1 TERMINAL-MODIFIED CONJUGATED DIENE-BASED POLYMER, RUBBER COMPOSITION, AND RUBBER ARTICLE BRIDGESTONE CORP (JP) 2023-04-19 EP disclosed
EP-3851489-A1 MODIFIED MULTI-COMPONENT COPOLYMER, RUBBER COMPOSITION, RESIN COMPOSITION, TIRE AND RESIN PRODUCT BRIDGESTONE CORPORATION (JP) 2021-07-21 EP disclosed
US-10875937-B2 Terminal-modified conjugated diene polymer, rubber composition and rubber article BRIDGESTONE CORPORATION (JP) 2020-12-29 US disclosed
CN-109071685-B Terminal-modified conjugated diene polymer, rubber composition, and rubber article 株式会社普利司通 2020-12-01 CN disclosed
WO-2020054484-A1 MODIFIED MULTI-COMPONENT COPOLYMER, RUBBER COMPOSITION, RESIN COMPOSITION, TIRE AND RESIN PRODUCT 株式会社ブリヂストン 2020-03-19 WO disclosed
US-20190161571-A1 TERMINAL-MODIFIED CONJUGATED DIENE POLYMER, RUBBER COMPOSITION, RUBBER PRODUCT AND METHOD FOR MANUFACTURING TERMINAL-MODIFIED CONJUGATED DIENE POLYMER BRIDGESTONE CORPORATION (JP) 2019-05-30 US disclosed
US-20190153123-A1 TERMINAL-MODIFIED CONJUGATED DIENE POLYMER, RUBBER COMPOSITION AND RUBBER ARTICLE BRIDGESTONE CORPORATION (JP) 2019-05-23 US disclosed
EP-3466985-A1 TERMINALLY MODIFIED CONJUGATED DIENE POLYMER, RUBBER COMPOSITION, RUBBER PRODUCT, AND METHOD FOR PRODUCING TERMINALLY MODIFIED CONJUGATED DIENE POLYMER Bridgestone Corporation (JP) 2019-04-10 EP disclosed
EP-3456746-A1 TERMINAL-MODIFIED CONJUGATED DIENE-BASED POLYMER, RUBBER COMPOSITION, AND RUBBER ARTICLE Bridgestone Corporation (JP) 2019-03-20 EP disclosed
EP-2098541-B1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER, AND RUBBER COMPOSITION JSR CORP (JP) 2013-06-05 EP disclosed
EP-0863165-B1 Method of producing conjugated diene polymers JSR CORP (JP) 2003-06-04 EP disclosed
US-6391990-B1 Method of producing conjugated diene polymer JSR CORPORATION (JP) 2002-05-21 US disclosed
US-6255416-B1 POLYMERIZING CONJUGATED DIENE COMPOUND WITH CATALYST CONSISTING ESSENTIALLY OF COMPOUND CONTAINING RARE EARTH ELEMENT, ALUMOXANE, ORGANOALUMINUM COMPOUND, REACTION PRODUCT OF METAL HALIDE AND LEWIS BASE JSR CORPORATION (JP) 2001-07-03 US disclosed
EP-1026181-A1 Method of producing conjugated diene polymer JSR Corporation (JP) 2000-08-09 EP disclosed
EP-0957115-A1 Method for producing conjugated diene polymers JSR Corporation (JP) 1999-11-17 EP disclosed
EP-0863165-A1 Method of producing conjugated diene polymers JSR Corporation (JP) 1998-09-09 EP disclosed
EP-0094093-B1 STABILIZED POLY(ARYLENE SULFIDE) COMPOSITION, PROCESS FOR MELT EXTRUDING SUCH COMPOSITION AND USE OF ORGANOTIN STABILIZERS IN POLY(ARYLENE SULFIDE) RESINS PHILLIPS PETROLEUM COMPANY (US) 1986-11-20 EP disclosed
EP-0094093-A1 Stabilized poly(arylene sulfide) composition, process for melt extruding such composition and use of organotin stabilizers in poly(arylene sulfide) resins PHILLIPS PETROLEUM COMPANY (US) 1983-11-16 EP disclosed
US-4411853-A DIALKYLTIN DICARBOXYLATES AS CURE RETARDERS FOR POLYARYLENE SULFIDES PHILLIPS PETROLEUM COMPANY (US) 1983-10-25 US disclosed
US-4089912-A DIALKYLTIN MALEATE, PHENOLIC ANTIOXIDANT; ESTERS, IMIDES, OR ANHYDRIDES OF CYCLIC DICARBOXYLIC ACIDS, OR POLYMERIC ESTERS GREAT LAKES CHEMICAL CORPORATION (US) 1978-05-16 US disclosed