Ethyl Fumarate

Ethyl Fumarate

SCHEMBL4566825

C=CCOC(=O)C=C.C=Cc1ccccc1.CCOC(=O)C=CC(=O)O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.50
MAPT P10636 6/20 0.43
LMNA P02545 4/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43
MDM2 Q00987 2/20 0.41
MDM4 O15151 1/20 0.41
APP P05067 1/20 0.40
ALDH1A1 P00352 3/20 0.40
THRB P10828 2/20 0.40
CYP3A4 P08684 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 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 SCHEMBL8427384 0.89 HCAR2 (0.62) HCAR2MAPTLMNAMEN1KMT2A
Styrene SCHEMBL9551543 0.89 HCAR2 (0.53) HCAR2MAPTLMNAMEN1KMT2A
Ethyl Fumarate SCHEMBL8427380 0.89 HCAR2 (0.62) HCAR2MAPTLMNAMEN1KMT2A
Styrene SCHEMBL3058331 0.89 HCAR2 (0.53) HCAR2MAPTLMNAMEN1KMT2A
Styrene SCHEMBL11673981 0.88 MAPT (0.45) MAPTLMNAMEN1KMT2AKDM4E
Ethyl Fumarate SCHEMBL1064537 0.88 HCAR2 (0.55) HCAR2MAPTLMNAMEN1KMT2A
Ethyl Fumarate SCHEMBL250119 0.85 HCAR2 (0.57) HCAR2MAPTLMNAKDM4EMDM2
Styrene SCHEMBL11061984 0.85 MEN1 (0.50) HCAR2MAPTLMNAMEN1KMT2A
Styrene SCHEMBL8175732 0.85 MEN1 (0.50) HCAR2MAPTLMNAMEN1KMT2A
Ethyl Fumarate SCHEMBL460704 0.85 HCAR2 (0.65) HCAR2MAPTAPPALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2260081-B1 SILICA ENCAPSULATED ORGANIC NANOPIGMENTS AND METHOD OF MAKING SAME XEROX CORP (US) 2014-11-26 EP disclosed
US-8815394-B2 Encapsulated nanoscale particles of organic pigments XEROX CORPORATION (US) 2014-08-26 US disclosed
US-8287637-B2 Silica encapsulated organic nanopigments and method of making same XEROX CORPORATION (US) 2012-10-16 US disclosed
US-20090246674-A1 SILICA ENCAPSULATED ORGANIC NANOPIGMENTS AND METHOD OF MAKING SAME XEROX CORPORATION (US) 2009-10-01 US disclosed
US-20090227711-A1 ENCAPSULATED NANOSCALE PARTICLES OF ORGANIC PIGMENTS XEROX CORPORATION (US) 2009-09-10 US disclosed