Fumaric Acid

Fumaric Acid

SCHEMBL9601552

CN(C)CCOc1ccc(N2N=C3c4cc(F)ccc4CCC3CC2=O)cc1.O=C(O)/C=C/C(=O)O

nearest known ligand 0.43

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 3/20 0.37
KMT2A known ✓ Q03164 3/20 0.37
DRD2 known ✓ P14416 1/20 0.34
L3MBTL1 Q9Y468 4/20 0.37
GAA P10253 3/20 0.37
MAPT P10636 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
RCE1 Q9Y256 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
RAD52 P43351 1/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.36
LSS P48449 1/20 0.35
THRB P10828 1/20 0.35
MAPK14 Q16539 1/20 0.35
SLC6A9 P48067 1/20 0.34
PLA2G7 Q13093 1/20 0.34

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 SCHEMBL9868348 1.00 L3MBTL1 (0.37) L3MBTL1MEN1KMT2AGAAMAPT
SCHEMBL9601499 0.89 ACHE (0.41) MAPTHRH3KDM4ESMN1; SMN2LSS
Fumaric Acid SCHEMBL9603160 0.88 KDM4E (0.35) GAAMAPTKDM4EALDH1A1LMNA
Fumaric Acid SCHEMBL9603164 0.88 KDM4E (0.35) GAAMAPTKDM4EALDH1A1LMNA
Fumaric Acid SCHEMBL9865899 0.87 ACHE (0.38) L3MBTL1MEN1KMT2AGAAMAPT
Maleic Acid SCHEMBL9865891 0.87 ACHE (0.38) L3MBTL1MEN1KMT2AGAAMAPT
Fumaric Acid SCHEMBL9867501 0.86 ALDH1A1 (0.35) MEN1KMT2AGAAMAPTTDP1
Fumaric Acid SCHEMBL9867491 0.86 ALDH1A1 (0.35) MEN1KMT2AGAAMAPTTDP1
Fumaric Acid SCHEMBL9602842 0.85 ALDH1A1 (0.34) MEN1KMT2AGAAMAPTTDP1
Fumaric Acid SCHEMBL9602836 0.85 ALDH1A1 (0.34) MEN1KMT2AGAAMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0351435-B1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1993-08-04 EP disclosed
US-5045541-A Immunodeficiency disorders YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-09-03 US disclosed
EP-0351435-A1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-24 EP disclosed