Fumaric Acid

Fumaric Acid

SCHEMBL4384166

N#CC(C#N)=C1N(CCCN2CCCCC2)CCN1CCNC1CCCCC1.O=C(O)/C=C/C(=O)O.O=C(O)/C=C/C(=O)O

nearest known ligand 0.59

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 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 14/20 0.59
HRH4 Q9H3N8 2/20 0.37
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
RAD52 P43351 2/20 0.36
DPP4 P27487 1/20 0.34

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 SCHEMBL4384167 1.00 HRH3 (0.59) HRH3HRH4TP53CYP1A2CYP3A4
SCHEMBL13788005 0.92 HRH3 (0.71) HRH3RAD52
SCHEMBL4397617 0.82 HRH3 (0.67) HRH3TP53CYP1A2CYP3A4CYP2D6
Fumaric Acid SCHEMBL4389636 0.80 HRH3 (0.61) HRH3HRH4
Fumaric Acid SCHEMBL4389632 0.80 HRH3 (0.61) HRH3HRH4
Fumaric Acid SCHEMBL4389628 0.80 HRH3 (0.61) HRH3HRH4
SCHEMBL4394477 0.77 HRH3 (1.00) HRH3CYP1A2
SCHEMBL4388303 0.77 HRH3 (1.00) HRH3CYP1A2
SCHEMBL4395380 0.77 HRH3 (1.00) HRH3CYP1A2
SCHEMBL4387811 0.77 HRH3 (1.00) HRH3CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090181948-A1 DIAMINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-07-16 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-20090181948-A1 DIAMINE DERIVATIVE ARG1, PRMT5, PRMT1 HRH3 452/4885HRH4 565/4885TP53 2329/4885

“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.