Fumaric Acid

Fumaric Acid

SCHEMBL4480491

CC(C)CN(Cc1ccccc1Oc1ccccc1)[C@H]1CCNC1.O=C(O)C=CC(=O)O

nearest known ligand 0.72

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 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 20/20 0.72
SLC6A4 known ✓ P31645 19/20 0.72
SLC6A3 known ✓ Q01959 9/20 0.66
KCNH2 known ✓ Q12809 1/20 0.60
CYP2D6 P10635 2/20 0.60

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 SCHEMBL4480486 1.00 SLC6A2 (0.72) SLC6A2SLC6A4SLC6A3CYP2D6KCNH2
Fumaric Acid SCHEMBL5995015 0.94 SLC6A2 (0.81) SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL5995019 0.94 SLC6A2 (0.81) SLC6A2SLC6A4SLC6A3
SCHEMBL4483628 0.92 SLC6A2 (0.67) SLC6A2SLC6A4SLC6A3CYP2D6KCNH2
Fumaric Acid SCHEMBL4499998 0.90 SLC6A2 (0.89) SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL4499991 0.90 SLC6A2 (0.89) SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL4486663 0.89 SLC6A2 (0.74) SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL4486657 0.89 SLC6A2 (0.74) SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL5440427 0.86 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3CYP2D6
Fumaric Acid SCHEMBL5440421 0.86 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3CYP2D6

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-7619096-B2 3-Aminopyrrolidines as inhibitors of monoamine uptake ELI LILLY AND COMPANY (US) 2009-11-17 US disclosed
US-20060270713-A1 3-Aminopyrrolidines as inhibitors of monoamine uptake ELI LILLY AND COMPANY 2006-11-30 US disclosed
EP-1638934-A1 3-AMINOPYRROLIDINES AS INHIBITORS OF MONOAMINE UPTAKE ELI LILLY AND COMPANY (US) 2006-03-29 EP disclosed
WO-2005000811-A1 3-AMINOPYRROLIDINES AS INHIBITORS OF MONOAMINE UPTAKE ELI LILLY AND COMPANY (US) 2005-01-06 WO 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-20060270713-A1 3-Aminopyrrolidines as inhibitors of monoamine uptake SLC6A2, SLC6A3, SLC18A2 SLC6A2 1/4885SLC6A4 5/4885SLC6A3 2/4885

“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.