Fumaric Acid

Fumaric Acid

SCHEMBL4349795

CC[C@H](C)CN.O=C(O)C=CC(=O)O

nearest known ligand 0.43

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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 1/20 0.39
KMT2A known ✓ Q03164 1/20 0.39
CACNA1C known ✓ Q13936 1/20 0.33
GABRP O00591 2/20 0.43
GABRD O14764 2/20 0.43
GABRA1 P14867 2/20 0.43
GABRB1 P18505 2/20 0.43
GABRG2 P18507 2/20 0.43
GABRB3 P28472 2/20 0.43
GABRA5 P31644 2/20 0.43
GABRA3 P34903 2/20 0.43
GABRA2 P47869 2/20 0.43
GABRB2 P47870 2/20 0.43
GABRA4 P48169 2/20 0.43
GABRE P78334 2/20 0.43
GABRA6 Q16445 2/20 0.43
GABRG1 Q8N1C3 2/20 0.43
GABRG3 Q99928 2/20 0.43
GABRQ Q9UN88 2/20 0.43
TSHR P16473 3/20 0.41

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 SCHEMBL28647188 0.78 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
Maleic Acid SCHEMBL28647190 0.78 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
Fumaric Acid SCHEMBL11362409 0.78 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
Maleic Acid SCHEMBL31293541 0.78 GABRP (0.54) GABRPGABRDGABRA1GABRB1GABRG2
Fumaric Acid SCHEMBL4267858 0.77 TSHR (0.60) GABRPGABRDGABRA1GABRB1GABRG2
Maleic Acid SCHEMBL5875011 0.77 TSHR (0.60) GABRPGABRDGABRA1GABRB1GABRG2
Fumaric Acid SCHEMBL5875027 0.77 TSHR (0.60) GABRPGABRDGABRA1GABRB1GABRG2
Maleic Acid SCHEMBL5875020 0.77 TSHR (0.60) GABRPGABRDGABRA1GABRB1GABRG2
Fumaric Acid SCHEMBL4267850 0.77 TSHR (0.60) GABRPGABRDGABRA1GABRB1GABRG2
Fumaric Acid SCHEMBL5875026 0.77 TSHR (0.60) GABRPGABRDGABRA1GABRB1GABRG2

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
US-20090286807-A1 CYCLIC AMINE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-11-19 US disclosed
EP-2036896-A1 CYCLIC AMINE COMPOUND Daiichi Sankyo Company, Limited (JP) 2009-03-18 EP 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-20090286807-A1 CYCLIC AMINE COMPOUND HRH3, HRH4, H1-0 MEN1 869/4885KMT2A 422/4885CACNA1C 1791/4885

“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.