Fumaric Acid

Fumaric Acid

SCHEMBL6290169

CNC(=O)OCCC1(N(C)C)CC1.O=C(O)/C=C/C(=O)O

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol

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 19)

geneUniProtsupporting neighboursconfidence
CHRM2 known ✓ P08172 1/20 0.37
CHRM3 known ✓ P20309 1/20 0.37
HRH1 known ✓ P35367 1/20 0.31
CHRNB2 P17787 2/20 0.43
CHRNA4 P43681 2/20 0.43
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CYP2D6 P10635 1/20 0.37
CHRM1 P11229 1/20 0.37
NFKB1 P19838 1/20 0.37
MAPK1 P28482 1/20 0.37
CHRNA7 P36544 1/20 0.37
LMNA P02545 1/20 0.36
APEX1 P27695 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
EPHX1 P07099 1/20 0.36
HCAR2 Q8TDS4 5/20 0.33
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31

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 SCHEMBL6290171 1.00 CHRNB2 (0.43) CHRNB2CHRNA4CHRM2CHRM4CHRM5
Fumaric Acid SCHEMBL6138408 0.92 CHRNB2 (0.41) CHRNB2CHRNA4CHRM2CHRM4CHRM5
Fumaric Acid SCHEMBL6138400 0.92 CHRNB2 (0.41) CHRNB2CHRNA4CHRM2CHRM4CHRM5
SCHEMBL6138367 0.91 CHRNB2 (0.46) CHRNB2CHRNA4CHRM2CHRM4CHRM5
Fumaric Acid SCHEMBL6294821 0.82 CHRNB2 (0.41) CHRNB2CHRNA4CHRM2CHRM4CHRM5
Fumaric Acid SCHEMBL6294820 0.82 CHRNB2 (0.41) CHRNB2CHRNA4CHRM2CHRM4CHRM5
SCHEMBL6138299 0.81 EPHX1 (0.47) CHRNB2CHRNA4CHRM2CHRM4CHRM5
Fumaric Acid SCHEMBL6138515 0.73 CHRNB2 (0.39) CHRNB2CHRNA4CHRM2CHRM4CHRM5
Fumaric Acid SCHEMBL6138512 0.73 CHRNB2 (0.39) CHRNB2CHRNA4CHRM2CHRM4CHRM5
SCHEMBL6137960 0.72 ALDH1A1 (0.39) CHRNB2CHRNA4CHRM2CHRM4CHRM5

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-6943184-B2 1,1- and 1,2-disubstituted cyclopropane compounds LES LABORATORIES SERVIER (FR) 2005-09-13 US disclosed
US-20050032845-A1 1,1-and 1,2-disubstituted cyclopropane compounds GOLDSTEIN SOLO (FR) 2005-02-10 US disclosed
US-20020022643-A1 1,1- and 1,2-disubstituted cyclopropane compounds ADIR ET COMPAGNIE (FR) 2002-02-21 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 (2 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-20050032845-A1 1,1-and 1,2-disubstituted cyclopropane compounds CHRNA1, CHRNA4, CHRNB1 CHRM2 20/4885CHRM3 15/4885HRH1 259/4885
US-20020022643-A1 1,1- and 1,2-disubstituted cyclopropane compounds HCAR1, CHRNA1, CNR1 CHRM2 32/4885CHRM3 23/4885HRH1 56/4885

“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.