Fumaric Acid

Fumaric Acid

SCHEMBL4344816

NC(=O)c1ccc(F)cc1.O=C(O)/C=C/C(=O)O

nearest known ligand 0.75

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
KMT2A known ✓ Q03164 2/20 0.44
PARP10 Q53GL7 5/20 0.50
MAOB P27338 1/20 0.50
PARP1 P09874 4/20 0.48
MAPT P10636 2/20 0.48
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
POLB P06746 1/20 0.48
CYP3A4 P08684 1/20 0.48
TSHR P16473 1/20 0.48
CYP2C19 P33261 1/20 0.48
RECQL P46063 1/20 0.48
BLM P54132 1/20 0.48
PMP22 Q01453 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PTGS1 P23219 1/20 0.47
BCL2L1 Q07817 1/20 0.47
BAD Q92934 1/20 0.47

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 SCHEMBL3023454 0.89 PARP10 (0.63) PARP10MAOBPARP1MAPTPOLB
Benzene SCHEMBL27719819 0.87 PARP1 (0.64) PARP10MAOBPARP1MAPTCES2
SCHEMBL12441973 0.87 CES2 (0.62) PARP10MAOBPARP1MAPTCES2
SCHEMBL52708 0.87 CES2 (0.62) PARP10MAOBPARP1MAPTCES2
Bromide SCHEMBL27321813 0.84 CES2 (0.59) PARP10MAOBPARP1MAPTCES2
Hydrochloric Acid SCHEMBL3845508 0.84 CES2 (0.59) PARP10MAOBPARP1MAPTCES2
Hydrochloric Acid SCHEMBL4375910 0.84 CES2 (0.59) PARP10MAOBPARP1MAPTCES2
Hydrochloric Acid SCHEMBL2859581 0.84 CES2 (0.59) PARP10MAOBPARP1MAPTCES2
Maleic Acid SCHEMBL28020629 0.83 BCL2L1 (0.68) MAPTCES2CES1TSHRCYP2C19
SCHEMBL6942827 0.81 ALDH1A1 (0.67) MAOBMAPTCES2CES1CYP3A4

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-20090286807-A1 CYCLIC AMINE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-11-19 US disclosed
EP-2036896-A1 CYCLIC AMINE COMPOUND Daiichi Sankyo Company, Limited (JP) 2009-03-18 EP 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-20090286807-A1 CYCLIC AMINE COMPOUND HRH3, HRH4, H1-0 KMT2A 422/4885PARP10 1470/4885MAOB 53/4885

“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.