Fumaric Acid

Fumaric Acid

SCHEMBL7564862

O=C(/C=C/C(=O)OC1CCCCC1)OC1CCCCC1.O=C(O)/C=C/C(=O)O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol

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 20)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 1/20 0.37
KMT2A known ✓ Q03164 1/20 0.37
ATM Q13315 1/20 0.47
HTT P42858 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
GAA P10253 1/20 0.46
EPHX1 P07099 2/20 0.42
HCAR2 Q8TDS4 3/20 0.41
CYP2C19 P33261 1/20 0.38
TSHR P16473 2/20 0.38
TP53 P04637 2/20 0.38
EGLN1 Q9GZT9 1/20 0.38
EGLN3 Q9H6Z9 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
NAAA Q02083 1/20 0.37
MITF O75030 1/20 0.37

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 SCHEMBL28065315 1.00 ATM (0.47) ATMHTTSMN1; SMN2NPC1GAA
Fumaric Acid SCHEMBL7564865 1.00 ATM (0.47) ATMHTTSMN1; SMN2NPC1GAA
Cyclohexyl Fumarate SCHEMBL528698 1.00 ATM (0.47) ATMHTTSMN1; SMN2NPC1GAA
SCHEMBL1087406 1.00 ATM (0.47) ATMHTTSMN1; SMN2NPC1GAA
Cyclohexyl Fumarate SCHEMBL528630 1.00 ATM (0.47) ATMHTTSMN1; SMN2NPC1GAA
SCHEMBL4158798 1.00 ATM (0.47) ATMHTTSMN1; SMN2NPC1GAA
SCHEMBL4156013 1.00 ATM (0.47) ATMHTTSMN1; SMN2NPC1GAA
SCHEMBL4156019 1.00 ATM (0.47) ATMHTTSMN1; SMN2NPC1GAA
Cyclohexyl Fumarate SCHEMBL528629 1.00 ATM (0.47) ATMHTTSMN1; SMN2NPC1GAA
SCHEMBL1087672 1.00 ATM (0.47) ATMHTTSMN1; SMN2NPC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020190818-A1 High frequency band pass filter TDK CORPORATION (JP) 2002-12-19 US disclosed
EP-0788118-B1 Low dielectric polymer and film, substrate and electronic part using the same TDK CORP (JP) 2002-11-20 EP disclosed
US-5914283-A FUMARIC ACID DIESTER MONOMER-CONTAINING POLYMER FILM; HEAT RESISTANCE, WEATHER RESISTANCE TDK CORPORATION (JP) 1999-06-22 US disclosed
EP-0788118-A1 Low dielectric polymer and film, substrate and electronic part using the same TDK Corporation (JP) 1997-08-06 EP disclosed