Fumaric Acid

Fumaric Acid

SCHEMBL9898674

CN1CCC[C@H]1CCNS(=O)(=O)c1ccc2c(c1)CN(CC1CCCCC1)CC2.O=C(O)C=CC(=O)O.O=C(O)C=CC(=O)O

nearest known ligand 0.41

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
HRH3 known ✓ Q9Y5N1 2/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HTR7 P34969 6/20 0.39
METAP2 P50579 2/20 0.38
MOGAT2 Q3SYC2 2/20 0.37
TP53 P04637 1/20 0.37

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 SCHEMBL9898673 1.00 TSHR (0.41) TSHRHRH3ALDH1A1HTR7METAP2
Fumaric Acid SCHEMBL9898162 0.99 TSHR (0.41) TSHRHRH3ALDH1A1HTR7METAP2
Fumaric Acid SCHEMBL2435682 0.99 TSHR (0.41) TSHRHRH3ALDH1A1HTR7METAP2
Fumaric Acid SCHEMBL27987046 0.99 TSHR (0.41) TSHRHRH3ALDH1A1HTR7METAP2
Fumaric Acid SCHEMBL2435679 0.99 TSHR (0.41) TSHRHRH3ALDH1A1HTR7METAP2
Oxalic Acid SCHEMBL1241171 0.95 HRH3 (0.44) TSHRHRH3ALDH1A1HTR7METAP2
SCHEMBL1241268 0.93 HRH3 (0.46) TSHRHRH3ALDH1A1HTR7MOGAT2
SCHEMBL2400927 0.93 HRH3 (0.46) TSHRHRH3ALDH1A1HTR7MOGAT2
Water SCHEMBL16161850 0.93 HRH3 (0.46) TSHRHRH3ALDH1A1HTR7MOGAT2
SCHEMBL5630601 0.90 HTR7 (0.45) TSHRHRH3ALDH1A1HTR7TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149728-A1 NOVEL FUMARATE SALTS OF A HISTAMINE H3 RECEPTOR ANTAGONIST SANOFI (FR) 2012-06-14 US claimed
EP-2445899-B1 NOVEL FUMARATE SALTS OF A HISTAMINE H3 RECEPTOR ANTAGONIST SANOFI SA (FR) 2016-05-11 EP disclosed
US-8664245-B2 Fumarate salts of a histamine H3 receptor antagonist SANOFI (FR) 2014-03-04 US disclosed
US-20120149728-A1 NOVEL FUMARATE SALTS OF A HISTAMINE H3 RECEPTOR ANTAGONIST SANOFI (FR) 2012-06-14 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-20120149728-A1 NOVEL FUMARATE SALTS OF A HISTAMINE H3 RECEPTOR ANTAGONIST HRH4, HRH3, HRH2 HRH3 2/4885TSHR 716/4885ALDH1A1 3119/4885

“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.