Fumaric Acid

Fumaric Acid

SCHEMBL1471480

CC1(C)CC(Nc2cc(F)ccc2Cl)CC(C)(C)N1.O=C(O)/C=C/C(=O)O

nearest known ligand 0.49

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 16)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 3/20 0.42
KMT2A known ✓ Q03164 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 4/20 0.40
PKM P14618 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
RAD52 P43351 1/20 0.40
GFER P55789 1/20 0.40
TSHR P16473 1/20 0.39
EZH2 Q15910 2/20 0.38
CYP2C19 P33261 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.37

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
SCHEMBL1473094 0.89 KMT2A (0.46) L3MBTL1MEN1KMT2AALDH1A1PKM
Fumaric Acid SCHEMBL1470857 0.88 MEN1 (0.47) L3MBTL1MEN1KMT2AALDH1A1PKM
Fumaric Acid SCHEMBL1471280 0.81 MEN1 (0.47) L3MBTL1MEN1KMT2AALDH1A1PKM
Fumaric Acid SCHEMBL1473011 0.79 KMT2A (0.46) L3MBTL1MEN1KMT2AALDH1A1PKM
Fumaric Acid SCHEMBL1472995 0.76 KDR (0.45) L3MBTL1MEN1KMT2AALDH1A1PKM
SCHEMBL1471326 0.76 KMT2A (0.47) L3MBTL1MEN1KMT2AALDH1A1PKM
Fumaric Acid SCHEMBL1472941 0.75 LMNA (0.46) L3MBTL1MEN1KMT2AALDH1A1PKM
Fumaric Acid SCHEMBL27681077 0.72 PTK2 (0.43) L3MBTL1MEN1KMT2AALDH1A1PKM
Fumaric Acid SCHEMBL27681072 0.71 KMT2A (0.44) L3MBTL1MEN1KMT2AALDH1A1PKM
Fumaric Acid SCHEMBL27661334 0.69 ALDH1A1 (0.51) L3MBTL1MEN1KMT2AALDH1A1PKM

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-20110086880-A1 NOVEL ALKYL SUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS PETERS DAN 2011-04-14 US disclosed
US-7915419-B2 Alkyl substituted piperidine derivatives and their use as monoamine neurotransmitter re-uptake inhibitors NEUROSEARCH A/S (DK) 2011-03-29 US disclosed
CN-1960974-A Alkyl substituted piperidine derivatives and their use as monoamine neurotransmitter re-uptake inhibitors NEUROSEARCH AS (DK) 2007-05-09 CN 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-20110086880-A1 NOVEL ALKYL SUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS SLC18A2, SLC6A2, SLC18A3 MEN1 2529/4885KMT2A 1498/4885L3MBTL1 4823/4885

“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.