Fumaric Acid

Fumaric Acid

SCHEMBL3496706

Cn1c(CN2CCCC2)cnc1-c1ccc(-n2cnc3ccccc32)cc1.O=C(O)C=CC(=O)O

nearest known ligand 0.43

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 16)

geneUniProtsupporting neighboursconfidence
HRH3 known ✓ Q9Y5N1 1/20 0.41
FLT3 known ✓ P36888 1/20 0.39
KDR P35968 7/20 0.42
FGFR1 P11362 2/20 0.41
HTT P42858 2/20 0.40
HTR7 P34969 1/20 0.40
NTRK1 P04629 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
PDE2A O00408 1/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38

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 SCHEMBL3496700 1.00 KDR (0.42) KDRFGFR1HRH3HTTHTR7
SCHEMBL3497636 0.91 HTT (0.46) KDRFGFR1HRH3HTTCYP11B1
Fumaric Acid SCHEMBL3497894 0.87 CYP11B1 (0.48) HRH3HTTCYP11B1CYP11B2
Fumaric Acid SCHEMBL3497899 0.87 CYP11B1 (0.48) HRH3HTTCYP11B1CYP11B2
Fumaric Acid SCHEMBL3496666 0.85 SIGMAR1 (0.47) HRH3CYP11B1CYP11B2
Fumaric Acid SCHEMBL3496670 0.85 SIGMAR1 (0.47) HRH3CYP11B1CYP11B2
Fumaric Acid SCHEMBL3497884 0.85 CYP11B1 (0.48) HRH3HTR7CYP11B1CYP11B2
Fumaric Acid SCHEMBL3497880 0.85 CYP11B1 (0.48) HRH3HTR7CYP11B1CYP11B2
Fumaric Acid SCHEMBL3496685 0.80 MCHR1 (0.40) HRH3CYP11B1CYP11B2
Fumaric Acid SCHEMBL3496686 0.80 MCHR1 (0.40) HRH3CYP11B1CYP11B2

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-7803825-B2 Aminoalkylazole derivatives as histamine-3 antagonists WYETH LLC (US) 2010-09-28 US disclosed
US-20090023707-A1 AMINOALKYLAZOLE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2009-01-22 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-20090023707-A1 AMINOALKYLAZOLE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS HRH4, HRH3, HRH2 HRH3 2/4885FLT3 2165/4885KDR 3105/4885

“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.