Fumaric Acid

Fumaric Acid

SCHEMBL6501301

CCOC(=O)CNC(=O)c1ccc(-c2ccc(N)cc2)cc1.O=C(O)C=CC(=O)O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

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 20)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 2/20 0.46
KMT2A known ✓ Q03164 2/20 0.46
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54
MAPT P10636 3/20 0.51
KDM4E B2RXH2 2/20 0.51
HIF1A Q16665 1/20 0.51
SLC22A6 Q4U2R8 1/20 0.51
SLC22A8 Q8TCC7 1/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
PPIB P23284 1/20 0.51
PPIA P62937 1/20 0.51
PPID Q08752 1/20 0.51
PPIG Q13427 1/20 0.51
TDP1 Q9NUW8 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47
TP53 P04637 2/20 0.47
GLA P06280 1/20 0.47
POLB P06746 1/20 0.47
HPGD P15428 1/20 0.46

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 SCHEMBL6501297 1.00 RAB9A (0.54) RAB9ANPC1MAPTKDM4EHIF1A
SCHEMBL11432192 0.88 NPC1 (0.67) RAB9ANPC1MAPTKDM4EHIF1A
SCHEMBL71818 0.83 RAB9A (0.66) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL1221369 0.76 RAB9A (0.66) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL13149442 0.76 TDP1 (0.77) RAB9ANPC1KDM4ESMN1; SMN2TDP1
SCHEMBL16263575 0.76 NPC1 (0.65) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL8768843 0.75 MAPT (0.62) RAB9ANPC1MAPTKDM4EHIF1A
SCHEMBL833589 0.75 NPC1 (0.68) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL10528940 0.75 KDM4E (0.66) RAB9ANPC1MAPTKDM4EHIF1A
SCHEMBL6487280 0.74 MAPT (0.63) RAB9ANPC1MAPTKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050065195-A1 Oxadiazolyl-biphenylcarboxamides and their use as p38 kinase inhibitors GLAXO GROUP LIMITED (GB) 2005-03-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050065195-A1 Oxadiazolyl-biphenylcarboxamides and their use as p38 kinase inhibitors MAPK3, MAPK1, MAPKAPK3 MEN1 4379/4885KMT2A 2259/4885RAB9A 2857/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.