Fumaric Acid

Fumaric Acid

SCHEMBL2884399

O=C(O)/C=C/C(=O)O.O=C(c1ccc(Cc2nc3ccccc3n2S(=O)(=O)c2ccccc2)cc1)N1CC[C@H](N2CCCC2)C1

nearest known ligand 0.56

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 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.56
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.45
L3MBTL3 Q96JM7 2/20 0.45
NPSR1 Q6W5P4 2/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
MBTD1 Q05BQ5 1/20 0.43
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
NPC1 O15118 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42

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 SCHEMBL2884404 1.00 HRH3 (0.56) HRH3LMNAGAAL3MBTL1L3MBTL3
SCHEMBL2878981 0.96 HRH3 (0.60) HRH3LMNAGAAL3MBTL1L3MBTL3
Fumaric Acid SCHEMBL2886359 0.85 HRH3 (0.64) HRH3L3MBTL1L3MBTL3TSHRMBTD1
Fumaric Acid SCHEMBL2886362 0.85 HRH3 (0.64) HRH3L3MBTL1L3MBTL3TSHRMBTD1
Fumaric Acid SCHEMBL2879166 0.84 HRH3 (0.62) HRH3L3MBTL1L3MBTL3
Fumaric Acid SCHEMBL2879169 0.84 HRH3 (0.62) HRH3L3MBTL1L3MBTL3
Fumaric Acid SCHEMBL2884241 0.84 HRH3 (0.62) HRH3L3MBTL1L3MBTL3MBTD1
Fumaric Acid SCHEMBL2884243 0.84 HRH3 (0.62) HRH3L3MBTL1L3MBTL3MBTD1
Fumaric Acid SCHEMBL2890842 0.83 HRH3 (0.63) HRH3L3MBTL1L3MBTL3
Fumaric Acid SCHEMBL2890847 0.83 HRH3 (0.63) HRH3L3MBTL1L3MBTL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US disclosed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 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-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists HNMT, HRH4, HRH3 HRH3 3/4885LMNA 4277/4885GAA 1425/4885

“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.