Fumaric Acid

Fumaric Acid

SCHEMBL4160620

C=CCOCC=C.CCC(CO)(CO)CO.O=C(O)C=CC(=O)O

nearest known ligand 0.36

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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 16)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 1/20 0.31
KMT2A known ✓ Q03164 1/20 0.31
HCAR2 Q8TDS4 6/20 0.36
THRB P10828 1/20 0.36
TP53 P04637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HIF1A Q16665 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 3/20 0.31
EGLN1 Q9GZT9 1/20 0.31
EGLN3 Q9H6Z9 1/20 0.31
POLB P06746 1/20 0.31

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
Maleic Acid SCHEMBL28197410 1.00 HCAR2 (0.36) HCAR2THRBTP53ALDH1A1CYP3A4
Acrylic Acid SCHEMBL7578570 0.91 THRB (0.40) THRBTP53ALDH1A1CYP3A4MAPK1
Acetic Acid SCHEMBL11582719 0.89 THRB (0.38) THRBTP53ALDH1A1CYP3A4MAPK1
SCHEMBL4147384 0.87 MEN1 (0.38) THRBTP53ALDH1A1CYP3A4MAPK1
SCHEMBL38754 0.87 MEN1 (0.38) THRBTP53ALDH1A1CYP3A4MAPK1
SCHEMBL6889697 0.87 ALDH1A1 (0.45) HCAR2THRBTP53ALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL28795774 0.85 MEN1 (0.36) THRBTP53ALDH1A1CYP3A4MAPK1
Propane SCHEMBL2147540 0.85 MEN1 (0.36) THRBTP53ALDH1A1CYP3A4MAPK1
SCHEMBL15918000 0.85 MEN1 (0.36) THRBTP53ALDH1A1CYP3A4MAPK1
Methacrylic Acid SCHEMBL1637663 0.85 THRB (0.35) THRBTP53ALDH1A1CYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0902803-B1 A THERMOPLASTIC COMPOUND PERSTORP AB (SE) 2004-09-22 EP claimed
EP-1187868-B1 HYPERBRANCHED DENDRITIC POLYETHER AND PROCESS FOR MANUFACTURE THEREOF PERSTORP AB (SE) 2004-07-07 EP claimed
US-6617418-B1 Thermally initiated cationic ring-opening polymerization of an oxetane having at least one reactive group in addition to the oxetane ether; end groups are hydroxyl PERSTORP AB (SE) 2003-09-09 US claimed
EP-0788524-B1 HYPERBRANCHED MACROMOLECULE OF POLYESTER TYPE PERSTORP AB (SE) 2003-02-05 EP claimed
US-6379683-B1 LIPID CORE ENCAPSULATED WITH POLYMER L'OREAL (FR) 2002-04-30 US claimed
EP-1187868-A1 HYPERBRANCHED DENDRITIC POLYETHER AND PROCESS FOR MANUFACTURE THEREOF PERSTORP AB (SE) 2002-03-20 EP claimed
EP-1034839-B1 Nanocapsules based on dendritic polymers OREAL (FR) 2001-10-24 EP claimed
US-6225404-B1 ADHESION, COMPATIBILITY PERSTORP AB (SE) 2001-05-01 US claimed
WO-2001012725-A1 CURABLE ANTIMICROBIAL HYPERBRANCHED POLYMER COMPOSITIONS NESTE CHEMICALS OY (FI) 2001-02-22 WO claimed
WO-2000056802-A1 HYPERBRANCHED DENDRITIC POLYETHER AND PROCESS FOR MANUFACTURE THEREOF PERSTORP AB (SE) 2000-09-28 WO claimed
US-6114458-A STAR POLYMER COMPRISING DENDRITIC MACROMOLECULAR INITIATOR, AND CHAIN EXTENDER MONOMERS INCLUDING A LACTONE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2000-09-05 US claimed
EP-0902803-A1 A THERMOPLASTIC COMPOUND PERSTORP AB (SE) 1999-03-24 EP claimed
EP-0630389-B1 DENDRITIC MACROMOLECULE, PROCESS FOR PREPARATION THEREOF AND USE THEREOF PERSTORP AB (SE) 1998-04-29 EP claimed
WO-1997045474-A1 A THERMOPLASTIC COMPOUND PERSTORP AB (SE) 1997-12-04 WO claimed
US-5663247-A POLYESTERS PERSTORP AB (SE) 1997-09-02 US claimed
EP-0788524-A1 HYPERBRANCHED MACROMOLECULE OF POLYESTER TYPE PERSTORP AB (SE) 1997-08-13 EP claimed
WO-1996012754-A1 HYPERBRANCHED MACROMOLECULE OF POLYESTER TYPE PERSTORP AB (SE) 1996-05-02 WO claimed
US-5418301-A Alkyd resins PERSTORP AB (SE) 1995-05-23 US claimed
EP-0630389-A1 DENDRITIC MACROMOLECULE, PROCESS FOR PREPARATION THEREOF AND USE THEREOF PERSTORP AB (SE) 1994-12-28 EP claimed
WO-1993017060-A1 DENDRITIC MACROMOLECULE, PROCESS FOR PREPARATION THEREOF AND USE THEREOF PERSTORP AB (SE) 1993-09-02 WO claimed