Fumaric Acid

Fumaric Acid

SCHEMBL4130133

CN(C)c1c(OCC2CC2)ccc2c(CCC3CCN(c4ccncn4)CC3)noc12.O=C(O)/C=C/C(=O)O

nearest known ligand 0.39

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 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.39
BCHE P06276 4/20 0.39
GPR119 Q8TDV5 1/20 0.37
F10 P00742 1/20 0.34
TAF1 P21675 1/20 0.33
CECR2 Q9BXF3 1/20 0.33
BRD9 Q9H8M2 1/20 0.33
RIPK1 Q13546 1/20 0.31
ACACB O00763 1/20 0.31
LSS P48449 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
SCHEMBL4126372 0.93 ACHE (0.40) ACHEBCHEGPR119F10TAF1
Fumaric Acid SCHEMBL4113038 0.88 ACHE (0.42) ACHEBCHE
Fumaric Acid SCHEMBL4130137 0.87 ACHE (0.39) ACHEBCHEGPR119F10RIPK1
Fumaric Acid SCHEMBL4130132 0.87 ACHE (0.39) ACHEBCHEGPR119F10RIPK1
Fumaric Acid SCHEMBL4113735 0.87 ACHE (0.40) ACHEBCHERIPK1
SCHEMBL4133004 0.80 ACHE (0.44) ACHEBCHE
SCHEMBL4126367 0.80 ACHE (0.38) ACHEBCHEGPR119F10
SCHEMBL4121348 0.79 ACHE (0.41) ACHEBCHE
Fumaric Acid SCHEMBL4127742 0.78 ACHE (0.38) ACHEBCHEACACB
Fumaric Acid SCHEMBL4127747 0.78 ACHE (0.38) ACHEBCHEACACB

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 ACHE 3716/4885BCHE 2215/4885GPR119 122/4885

“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.