Fumaric Acid

Fumaric Acid

SCHEMBL9507151

C=COC(=O)CCCCCCCCCCC.O=C(O)/C=C/C(=O)O

nearest known ligand 0.57

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 0.44
KMT2A known ✓ Q03164 1/20 0.44
TSHR P16473 4/20 0.57
HCAR2 Q8TDS4 2/20 0.49
PAM P19021 2/20 0.47
DGKA P23743 1/20 0.47
LMNA P02545 2/20 0.44
PPARG P37231 5/20 0.44
PPARD Q03181 5/20 0.44
PPARA Q07869 5/20 0.44
HDAC11 Q96DB2 4/20 0.44
GPR84 Q9NQS5 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TLR2 O60603 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
FABP4 P15090 2/20 0.44
PTPN1 P18031 2/20 0.44
SLC22A6 Q4U2R8 1/20 0.44
SLC22A8 Q8TCC7 1/20 0.44
ESR1 P03372 1/20 0.44

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 SCHEMBL9507155 1.00 TSHR (0.57) TSHRHCAR2PAMDGKALMNA
Maleic Acid SCHEMBL11159534 0.95 TSHR (0.53) TSHRHCAR2PAMDGKALMNA
Acrylic Acid SCHEMBL28337927 0.91 TSHR (0.59) TSHRPAMDGKALMNAPPARG
Bicarbonate SCHEMBL3894794 0.91 TSHR (0.62) TSHRPAMDGKALMNAPPARG
SCHEMBL25420469 0.91 TSHR (0.67) TSHRPAMDGKALMNAPPARG
SCHEMBL7540354 0.91 TSHR (0.67) TSHRPAMDGKALMNAPPARG
SCHEMBL20476 0.91 TSHR (0.67) TSHRPAMDGKALMNAPPARG
SCHEMBL10543145 0.91 TSHR (0.67) TSHRPAMDGKALMNAPPARG
SCHEMBL18055 0.91 TSHR (0.67) TSHRPAMDGKALMNAPPARG
SCHEMBL953501 0.91 TSHR (0.67) TSHRPAMDGKALMNAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0200431-B1 DEWAXING WAXY HYDROCARBON OILS USING DI-ALKYL FUMARATE-VINYL LAURATE COPOLYMER DEWAXING AIDS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1993-09-01 EP disclosed
EP-0200431-A2 Dewaxing waxy hydrocarbon oils using di-alkyl fumarate-vinyl laurate copolymer dewaxing aids EXXON RESEARCH AND ENGINEERING COMPANY (US) 1986-11-05 EP disclosed