Fumaric Acid

Fumaric Acid

SCHEMBL7103108

CCS(=O)(=O)Nc1cccc2c1SCCC2c1c[nH]cn1.O=C(O)C=CC(=O)O

nearest known ligand 0.58

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 7)

geneUniProtsupporting neighboursconfidence
ADRA2A known ✓ P08913 2/20 0.39
ADRA1A known ✓ P35348 2/20 0.38
KCNH2 known ✓ Q12809 2/20 0.31
DRD2 known ✓ P14416 1/20 0.30
DRD1 known ✓ P21728 1/20 0.30
HTR2A known ✓ P28223 1/20 0.30
KCNA5 P22460 1/20 0.31

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 SCHEMBL7103102 1.00 ADRA2A (0.39) ADRA2AADRA1AKCNH2KCNA5DRD2
SCHEMBL7101674 0.93 ADRA2A (0.44) ADRA2AADRA1ADRD2DRD1
Maleic Acid SCHEMBL7098093 0.83 ADRA2A (0.58) ADRA2AADRA1A
Fumaric Acid SCHEMBL7098102 0.83 ADRA2A (0.58) ADRA2AADRA1A
SCHEMBL7098531 0.83 ADRA2A (0.43) ADRA2AADRA1A
Maleic Acid SCHEMBL7102046 0.76 ADRA2A (0.42) ADRA2AADRA1AKCNH2DRD2DRD1
Fumaric Acid SCHEMBL7102052 0.76 ADRA2A (0.42) ADRA2AADRA1AKCNH2DRD2DRD1
SCHEMBL7100769 0.76 ADRA2A (0.65) ADRA2AADRA1ADRD2DRD1
SCHEMBL7103106 0.75
SCHEMBL7100485 0.74 ADRA2A (0.66) ADRA2AADRA1A

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-20030073850-A1 4-Imidazole derivatives of benzyl and restricted benzyl sulfonamides, sulfamides, ureas, carbamates, and amides and their use ABBOTT LABORATORIES 2003-04-17 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-20030073850-A1 4-Imidazole derivatives of benzyl and restricted benzyl sulfonamides, sulfamides, ureas, carbamates, and amides and their use ADRA1D, ADRB1, ADRA1A ADRA2A 8/4885ADRA1A 3/4885KCNH2 940/4885

“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.