Fumaric Acid

Fumaric Acid

SCHEMBL7537262

COc1ccccc1N1CCNC(CC(C)N(C(=O)C2CCCCC2)C(=O)C2CCCCC2)C1.O=C(O)/C=C/C(=O)O

nearest known ligand 0.52

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 20)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 3/20 0.52
KMT2A known ✓ Q03164 3/20 0.52
ADRB1 known ✓ P08588 1/20 0.44
HTR2B known ✓ P41595 1/20 0.44
SLC6A2 known ✓ P23975 1/20 0.41
SLC6A4 known ✓ P31645 1/20 0.41
DRD2 known ✓ P14416 1/20 0.40
LMNA P02545 1/20 0.52
BLM P54132 1/20 0.52
PMP22 Q01453 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HTR1A P08908 4/20 0.47
ADRA1A P35348 4/20 0.44
DRD4 P21917 3/20 0.44
ADRA1D P25100 3/20 0.44
ADRA1B P35368 3/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
TSHR P16473 1/20 0.44
HTR1B P28222 1/20 0.44

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 SCHEMBL7537269 1.00 MEN1 (0.52) MEN1KMT2ALMNABLMPMP22
Fumaric Acid SCHEMBL7989873 0.81 HTR1A (0.67) MEN1KMT2ALMNABLMPMP22
Way-100,635 SCHEMBL29519870 0.68 SMN1; SMN2 (1.00) MEN1KMT2ALMNABLMPMP22
Way-100,635 SCHEMBL4077972 0.68 SMN1; SMN2 (1.00) MEN1KMT2ALMNABLMPMP22
Way-100,635 SCHEMBL4077975 0.68 SMN1; SMN2 (1.00) MEN1KMT2ALMNABLMPMP22
Way-100,635 SCHEMBL30366505 0.68 SMN1; SMN2 (1.00) MEN1KMT2ALMNABLMPMP22
SCHEMBL9413238 0.65 DRD2 (0.51) LMNAHTR1AHTR7ADRB1SLC6A2
Hydrochloric Acid SCHEMBL7536688 0.65 HTR1A (0.72) MEN1KMT2ALMNABLMPMP22
SCHEMBL6933223 0.64 HTR1A (0.75) MEN1KMT2ALMNABLMPMP22
SCHEMBL25407029 0.64 DRD2 (0.64) LMNASMN1; SMN2HTR1AHTR7ADRB1

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-20020013324-A1 N-substituted imide derivatives with serotonergic activity AMERICAN HOME PRODUCTS CORPORATION 2002-01-31 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-20020013324-A1 N-substituted imide derivatives with serotonergic activity TPH1, HTR1A, HTR1E MEN1 389/4885KMT2A 1355/4885ADRB1 115/4885

“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.