Fumaric Acid

Fumaric Acid

SCHEMBL9602815

CN(C)CCCOc1ccccc1N1N=C2c3ccccc3CCC2CC1=O.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
HRH1 known ✓ P35367 4/20 0.43
MEN1 known ✓ O00255 1/20 0.35
KMT2A known ✓ Q03164 1/20 0.35
SLC6A4 known ✓ P31645 1/20 0.33
KDM4E B2RXH2 5/20 0.39
ACHE P22303 1/20 0.39
CACNA1B Q00975 1/20 0.37
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
RECQL P46063 2/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
PMP22 Q01453 1/20 0.35
NPC1 O15118 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
CASP3 P42574 1/20 0.34
RAB9A P51151 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 SCHEMBL9602822 1.00 HRH1 (0.43) HRH1KDM4EACHECACNA1BALDH1A1
Fumaric Acid SCHEMBL9865899 0.77 ACHE (0.38) ACHECACNA1BALDH1A1MEN1KMT2A
Maleic Acid SCHEMBL9865891 0.77 ACHE (0.38) ACHECACNA1BALDH1A1MEN1KMT2A
Fumaric Acid SCHEMBL9601552 0.74 L3MBTL1 (0.37) KDM4EACHEALDH1A1SMN1; SMN2MEN1
Fumaric Acid SCHEMBL9868348 0.74 L3MBTL1 (0.37) KDM4EACHEALDH1A1SMN1; SMN2MEN1
SCHEMBL9866167 0.73 ACHE (0.40) KDM4EACHECACNA1B
Fumaric Acid SCHEMBL9865075 0.73 MAOB (0.44) HRH1KDM4EACHECACNA1BALDH1A1
Fumaric Acid SCHEMBL10445064 0.73 MAOB (0.44) HRH1KDM4EACHECACNA1BALDH1A1
Maleic Acid SCHEMBL9602648 0.73 CYP1A2 (0.40) LMNASLC6A4
SCHEMBL9602148 0.72 KDM4E (0.45) KDM4EACHEALDH1A1RECQLNPC1

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