Fumaric Acid

Fumaric Acid

SCHEMBL3701419

C=C(C)OC(=C)C.O=C(O)C=CC(=O)O

nearest known ligand 0.52

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
HSD17B10 Q99714 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
TSHR P16473 4/20 0.50
TP53 P04637 1/20 0.50
EGLN1 Q9GZT9 1/20 0.50
EGLN3 Q9H6Z9 1/20 0.50
HCAR2 Q8TDS4 7/20 0.46
ALDH1A1 P00352 5/20 0.41
ALOX15 P16050 2/20 0.41
RECQL P46063 2/20 0.41
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
GAA P10253 1/20 0.36
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRB1 P18505 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33

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 SCHEMBL251369 1.00 HSD17B10 (0.52) HSD17B10TDP1TSHRTP53EGLN1
Maleic Acid SCHEMBL4507841 0.97 HSD17B10 (0.50) HSD17B10TDP1TSHRTP53EGLN1
Fumaric Acid SCHEMBL9248586 0.97 HSD17B10 (0.50) HSD17B10TDP1TSHRTP53EGLN1
Maleic Acid SCHEMBL10493320 0.90 HSD17B10 (0.70) HSD17B10TDP1TSHRTP53EGLN1
SCHEMBL1014778 0.87 HCAR2 (0.52) HSD17B10TDP1TSHRTP53EGLN1
SCHEMBL4168638 0.87 HCAR2 (0.52) HSD17B10TDP1TSHRTP53EGLN1
Monomethyl Fumarate SCHEMBL7123923 0.87 HCAR2 (0.71) HSD17B10TDP1TSHRTP53EGLN1
Maleic Acid SCHEMBL713343 0.82 TSHR (0.64) HSD17B10TDP1TSHRTP53EGLN1
Fumaric Acid SCHEMBL713345 0.82 TSHR (0.64) HSD17B10TDP1TSHRTP53EGLN1
Maleic Acid SCHEMBL342490 0.82 TSHR (0.64) HSD17B10TDP1TSHRTP53EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130338198-A1 COMPOSITION FOR TREATING DERMATITIS AND ICHTHYOSIS, AND METHOD FOR TREATING DERMATITIS AND ICHTHYOSIS SKINVISIBLE PHARMACEUTICALS, INC. (US) 2013-12-19 US claimed
US-10292917-B2 Oral care composition COLGATE-PALMOLIVE COMPANY (US) 2019-05-21 US disclosed
EP-2934689-B1 ORAL CARE COMPOSITION GABA INT HOLDING GMBH (CH) 2017-09-27 EP disclosed
EP-2519215-B1 ORAL CARE COMPOSITION COLGATE PALMOLIVE CO (US) 2016-08-24 EP disclosed
US-20150366768-A1 Oral Care Composition GABA INTERNATIONAL HOLDING AG (CH) 2015-12-24 US disclosed
EP-2934689-A1 ORAL CARE COMPOSITION GABA International Holding AG (CH) 2015-10-28 EP disclosed
US-20140219951-A1 AMIDO-AMINE DENDRIMER COMPOSITIONS GENZYME CORPORATION (US) 2014-08-07 US disclosed
WO-2014094900-A1 ORAL CARE COMPOSITION GABA INTERNATIONAL HOLDING AG (CH) 2014-06-26 WO disclosed
EP-2200566-A1 IMPROVED TOPICAL PAIN RELIEF PRODUCT McNeil-PPC, Inc. (US) 2010-06-30 EP disclosed
US-20090098173-A1 TOPICAL PAIN RELIEF PRODUCT MCNEIL-PPC, INC. 2009-04-16 US disclosed
WO-2009049190-A1 IMPROVED TOPICAL PAIN RELIEF PRODUCT MCNEIL-PPC, INC. (US) 2009-04-16 WO disclosed
US-6756059-B2 PREPARED BY MELT PROCESSING A HYDROPHOBIC POLYMER COMPOSITION THAT INCLUDES REPEATING PYRROLIDONE/ALKYLENE GROUPS CONTAINING AT LEAST 10 CARBON ATOMS, AND A HYDROPHILIC POLYMER COMPOSITION INCLUDING REPEATING CARBOXYLIC OR HYDROXYL GROUPS SKINVISIBLE PHARMACEUTICALS, INC. 2004-06-29 US disclosed
EP-0957117-B1 Continuous process for producing rubbery polymer ELIOKEM SAS (FR) 2003-10-08 EP disclosed
US-20030044436-A1 Topical composition, topical composition precursor, and methods for manufacturing and using SKINVISIBLE PHARMACEUTICALS, INC. 2003-03-06 US disclosed
US-6077903-A FIRST PHASE MONOMER SOLUTION CONTAINING BUTYL ACRYLATE, AN ACRYLIC MONOMER, ACRYLONITRILE AND A CROSSLINKING AGENT IS CHARGED INTO AT LEAST THREE INITIAL REACTORS; SECOND PHASE MONOMER SOLUTION CONTAINING STYRENE AND ACRYLONITRILE THE GOODYEAR TIRE RUBBER COMPANY (US) 2000-06-20 US disclosed
EP-0957117-A1 Continuous process for producing rubbery polymer THE GOODYEAR TIRE & RUBBER COMPANY (US) 1999-11-17 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 (3 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-20130338198-A1 COMPOSITION FOR TREATING DERMATITIS AND ICHTHYOSIS, AND METHOD FOR TREATING DERMATITIS AND ICHTHYOSIS CUTA, SERPINB1, PRSS1 HSD17B10 951/4885TDP1 412/4885TSHR 2104/4885
US-20140219951-A1 AMIDO-AMINE DENDRIMER COMPOSITIONS PAM, ARGLU1, NAAA HSD17B10 4694/4885TDP1 4016/4885TSHR 1091/4885
US-20030044436-A1 Topical composition, topical composition precursor, and methods for manufacturing and using CUTA, DHPS, TSLP HSD17B10 107/4885TDP1 224/4885TSHR 4842/4885

“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.