Fumaric Acid

Fumaric Acid

SCHEMBL267835

CC(C)(C)NC(=O)c1ccc(C(F)(F)F)nc1C[C@H](O)[C@H](N)Cc1cc(F)ccc1F.O=C(O)C=CC(=O)O

nearest known ligand 0.35

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 14)

geneUniProtsupporting neighboursconfidence
DPP4 known ✓ P27487 14/20 0.35
SLC6A2 known ✓ P23975 1/20 0.33
SLC6A4 known ✓ P31645 1/20 0.33
DPP8 Q6V1X1 11/20 0.35
DPP9 Q86TI2 7/20 0.35
DPP7 Q9UHL4 6/20 0.35
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PDE4B Q07343 1/20 0.32
PDE11A Q9HCR9 1/20 0.32
ACKR3 P25106 1/20 0.32

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 SCHEMBL267834 1.00 DPP4 (0.35) DPP4DPP8DPP9DPP7ALOX5AP
SCHEMBL269639 0.95 DPP4 (0.38) DPP4DPP8DPP9DPP7ALOX5AP
SCHEMBL267506 0.95 DPP4 (0.38) DPP4DPP8DPP9DPP7ALOX5AP
Hydrochloric Acid SCHEMBL268733 0.94 DPP4 (0.37) DPP4DPP8DPP9DPP7ALOX5AP
SCHEMBL269056 0.92 DPP4 (0.35) DPP4DPP8DPP9DPP7ALOX5AP
SCHEMBL269161 0.87 ANO1 (0.40) DPP4DPP9ALOX5APFEN1PDE4B
Hydrochloric Acid SCHEMBL270205 0.86 ANO1 (0.40) DPP4DPP9ALOX5APFEN1PDE4B
SCHEMBL270299 0.86 DPP4 (0.39) DPP4DPP8DPP9DPP7ALOX5AP
SCHEMBL269134 0.84 LMNA (0.41) DPP4DPP8ALOX5APFEN1TRPV1
SCHEMBL269630 0.81 SCN9A (0.36) DPP4DPP8DPP9DPP7ALOX5AP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133907-B2 Type II diabetes, obesity, hyperglycemia and a lipid disorder selected from dyslipidemia, hyperlipidemia, hypertriglyceridemia, hypercholesterolemia, low HDL and high LDL; additionally comprising metformin ELI LILLY AND COMPANY (US) 2012-03-13 US disclosed
EP-1912946-B1 PYRIDINE DERIVATIVES AS DIPEPTEDYL PEPTIDASE INHIBITORS LILLY CO ELI (US) 2009-05-27 EP disclosed
US-20080214616-A1 Pyridine Derivatives as Dipeptedyl Peptidase Inhibitors ELI LILLY AND COMPANY 2008-09-04 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-20080214616-A1 Pyridine Derivatives as Dipeptedyl Peptidase Inhibitors DPP4, DPP3, DPP7 DPP4 1/4885SLC6A2 1114/4885SLC6A4 230/4885

“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.