Fumaric Acid

Fumaric Acid

SCHEMBL4127747

CN(C)Cc1c(OCC2CC2)ccc2c(CCC3CCN(c4cccnn4)CC3)noc12.O=C(O)C=CC(=O)O

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol

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 8)

geneUniProtsupporting neighboursconfidence
AXL known ✓ P30530 2/20 0.31
PPARG known ✓ P37231 2/20 0.31
ACHE P22303 12/20 0.38
BCHE P06276 4/20 0.38
PPARD Q03181 2/20 0.31
PPARA Q07869 2/20 0.31
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31

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 SCHEMBL4127742 1.00 ACHE (0.38) ACHEBCHEAXLPPARGPPARD
SCHEMBL4130389 0.93 ACHE (0.39) ACHEBCHE
Fumaric Acid SCHEMBL4113735 0.91 ACHE (0.40) ACHEBCHE
Fumaric Acid SCHEMBL4113738 0.90 ACHE (0.40) ACHEBCHEPPARGPPARDPPARA
Fumaric Acid SCHEMBL4113730 0.90 ACHE (0.40) ACHEBCHEPPARGPPARDPPARA
Fumaric Acid SCHEMBL4127841 0.88 ACHE (0.42) ACHEBCHEPPARGPPARDPPARA
Fumaric Acid SCHEMBL4127846 0.88 ACHE (0.42) ACHEBCHEPPARGPPARDPPARA
SCHEMBL4129693 0.86 ACHE (0.35) ACHEBCHEACACBACACA
SCHEMBL4127001 0.84 ACHE (0.42) ACHEBCHE
Fumaric Acid SCHEMBL4118975 0.84 ACHE (0.41) ACHEBCHE

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-20090318690-A1 Benzisoxazole Compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-12-24 US disclosed
EP-2017275-A1 BENZISOXAZOLE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2009-01-21 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-20090318690-A1 Benzisoxazole Compound NR1I2, NR1I3, NR0B1 AXL 3432/4885PPARG 498/4885ACHE 3716/4885

“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.