SCHEMBL5486609

SCHEMBL5486609

C/C(=C\C(=O)[O-])C(=O)[O-].[Mg+2]

nearest known ligand 0.42

Known targets — ChEMBL curated mechanism

ATP4AATP4BGABBR1GABBR2HMGCR

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA4 P22748 3/20 0.42
CA1 P00915 2/20 0.39
FAHD1 Q6P587 1/20 0.32

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
SCHEMBL11527646 1.00 CA4 (0.42) CA4CA1FAHD1
Potassium Ion SCHEMBL29684679 0.97 CA4 (0.44) CA4CA1FAHD1
SCHEMBL31656550 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL285039 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL31492942 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL8089675 0.94 CA4 (0.47) CA4CA1FAHD1
SCHEMBL4934869 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL11525049 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL285040 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL4934880 0.94 CA4 (0.42) CA4CA1FAHD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1663197-B1 THE USE OF FUMARIC ACID DERIVATIVES FOR TREATING CARDIAC INSUFFICIENCY, AND ASTHMA FUMAPHARM AG (CH) 2007-12-05 EP claimed
EP-1248606-B1 USE OF FUMARIC ACID DERIVATIVES FOR TREATING MITOCHONDRIAL DISEASES FUMAPHARM AG (CH) 2006-06-14 EP claimed
EP-1408947-A2 FUMARIC ACID DERIVATIVES AS NF-KAPPAB INHIBITORS Fumapharm AG (CH) 2004-04-21 EP claimed
EP-1248606-A1 USE OF FUMARIC ACID DERIVATIVES FOR TREATING MITOCHONDRIAL DISEASES Fumapharm AG (CH) 2002-10-16 EP claimed
WO-2002055067-A2 FUMARIC ACID DERIVATIVES AS NF-KAPPAB INHIBITORS FUMAPHARM AG (CH) 2002-07-18 WO claimed
WO-2002055066-A1 FUMARIC ACID DERIVATIVES AS NF-KAPPA-B INHIBITORS FUMAPHARM AG (CH) 2002-07-18 WO claimed
WO-2001051047-A1 USE OF FUMARIC ACID DERIVATIVES FOR TREATING MITOCHONDRIAL DISEASES FUMAPHARM AG (CH) 2001-07-19 WO claimed
EP-1248606-B1 USE OF FUMARIC ACID DERIVATIVES FOR TREATING MITOCHONDRIAL DISEASES FUMAPHARM AG (CH) 2006-06-14 EP disclosed
WO-2002055066-A1 FUMARIC ACID DERIVATIVES AS NF-KAPPA-B INHIBITORS FUMAPHARM AG (CH) 2002-07-18 WO disclosed