Fumaric Acid

Fumaric Acid

SCHEMBL3825816

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

nearest known ligand 0.75

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
TSHR P16473 4/20 0.75
TP53 P04637 1/20 0.75
EGLN1 Q9GZT9 1/20 0.75
EGLN3 Q9H6Z9 1/20 0.75
HCAR2 Q8TDS4 4/20 0.53
ALDH1A1 P00352 4/20 0.52
ALOX15 P16050 2/20 0.52
RECQL P46063 2/20 0.52
HSD17B10 Q99714 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
LMNA P02545 3/20 0.50
FFAR3 O14843 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
GAA P10253 1/20 0.46
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

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 SCHEMBL15689651 1.00 TSHR (0.75) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL8865128 1.00 TSHR (0.75) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL30577889 0.96 TSHR (0.69) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL8864870 0.96 TSHR (0.69) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL9474609 0.92 TSHR (0.75) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL289218 0.92 TSHR (0.75) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL28825253 0.92 TSHR (0.75) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL8032158 0.92 TSHR (0.75) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL28369738 0.92 TSHR (0.75) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL289217 0.92 TSHR (0.75) TSHRTP53EGLN1EGLN3HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2985023-A1 PROCESS FOR PREPARING PRASUGREL Laboratorios Lesvi, S.L. (ES) 2016-02-17 EP disclosed
EP-2736509-B1 PROCESS FOR PREPARING PRASUGREL LESVI LABORATORIOS SL (ES) 2015-09-23 EP disclosed
EP-2917213-A1 CRYSTALLINE FORMS OF (1S)-1-[5-({3-[(2-METHYLPYRIDIN-3-YL)OXY]-5-(PYRIDIN-2-YLSULFANYL)PYRIDIN-2-YL}AMINO)-1,2,4-THIADIAZOL-3-YL]ETHANE-1,2-DIOL Array Biopharma, Inc. (US) 2015-09-16 EP disclosed
WO-2014074940-A9 CRYSTALLINE FORMS OF (1S)-1-[5-({3-[(2-METHYLPYRIDIN-3-YL)OXY]-5-(PYRIDIN-2-YLSULFANYL)PYRIDIN-2-YL}AMINO)-1,2,4-THIADIAZOL-3-YL]ETHANE-1,2-DIOL ARRAY BIOPHARMA INC. (US) 2014-08-07 WO disclosed
EP-2736509-A1 PROCESS FOR PREPARING PRASUGREL Laboratorios Lesvi, S.L. (ES) 2014-06-04 EP disclosed
WO-2014074940-A1 CRYSTALLINE FORMS OF (1S)-1-[5-({3-[(2-METHYLPYRIDIN-3-YL)OXY]-5-(PYRIDIN-2-YLSULFANYL)PYRIDIN-2-YL}AMINO)-1,2,4-THIADIAZOL-3-YL]ETHANE-1,2-DIOL ARRAY BIOPHARMA INC. (US) 2014-05-15 WO disclosed
EP-2099760-B1 ANTIBACTERIAL QUINOLINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2013-02-20 EP disclosed
WO-2013014295-A1 PROCESS FOR PREPARING PRASUGREL LABORATORIOS LESVI, S. L. (ES) 2013-01-31 WO disclosed
EP-2099760-A1 ANTIBACTERIAL QUINOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2009-09-16 EP disclosed
WO-2008068268-A1 ANTIBACTERIAL QUINOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2008-06-12 WO disclosed
US-5624922-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1997-04-29 US disclosed
US-5380721-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1995-01-10 US disclosed
US-4281010-A FOR INCREASING BLOOD CIRCULATION DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1981-07-28 US disclosed
US-4254269-A PRECURSERS FOR CARDIOVASCULAR DRUGS DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1981-03-03 US disclosed
US-4206213-A IMPROVING PERIPHERAL AND CEREBRAL CIRCULATION DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1980-06-03 US disclosed