Ethyl Fumarate

Ethyl Fumarate

SCHEMBL6440837

CCOC(=O)C=CC(=O)[O-].[Mg+]

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.61
MAPT P10636 6/20 0.46
ATM Q13315 1/20 0.45
NPSR1 Q6W5P4 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
LMNA P02545 3/20 0.41
MDM2 Q00987 1/20 0.41
ALDH1A1 P00352 4/20 0.41
THRB P10828 1/20 0.41
TTR P02766 1/20 0.40
DPP4 P27487 1/20 0.40
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
Ethyl Fumarate SCHEMBL30387534 1.00 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL31439648 1.00 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL1902730 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL9435698 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL5016627 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL1905731 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL1904374 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL1903287 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL20594713 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12
Ethyl Fumarate SCHEMBL1904369 0.95 HCAR2 (0.61) HCAR2MAPTATMNPSR1CA12

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-6858750-B2 Use of fumaric acid derivatives for treating mitochondrial diseases FUMAPHARM AG (CH) 2005-02-22 US disclosed
US-6277882-B1 SKIN DISORDERS FUMAPHARM AG (CH) 2001-08-21 US disclosed