Ethyl Fumarate

Ethyl Fumarate

SCHEMBL250291

C=C(C=CC#N)C(=O)OCCCC.C=Cc1ccccc1.CCOC(=O)C=CC(=O)O

nearest known ligand 0.44

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Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 7/20 0.44
ATM Q13315 1/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPT P10636 6/20 0.35
LMNA P02545 4/20 0.35
ALDH1A1 P00352 2/20 0.35
THRB P10828 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
APP P05067 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MDM2 Q00987 2/20 0.34
MDM4 O15151 1/20 0.34

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
Styrene SCHEMBL251741 0.92 KDM4E (0.41) HCAR2ATMKDM4ELMNAALDH1A1
Styrene SCHEMBL3958178 0.91 KDM4E (0.39) HCAR2ATMKDM4EMAPTLMNA
Styrene SCHEMBL2061795 0.88 ALDH1A1 (0.39) HCAR2KDM4EMAPTALDH1A1MEN1
Ethyl Fumarate SCHEMBL1011556 0.86 HCAR2 (0.50) HCAR2ATMKDM4EMAPTLMNA
Styrene SCHEMBL250640 0.85 HCAR2 (0.47) HCAR2ATMKDM4EMAPTLMNA
Styrene SCHEMBL8844775 0.85 KMT2A (0.48) KDM4EMAPTLMNAALDH1A1MEN1
Styrene SCHEMBL251244 0.84 HCAR2 (0.38) HCAR2KDM4EMAPTLMNAALDH1A1
Styrene SCHEMBL15158014 0.83 TSHR (0.43) HCAR2KDM4EMAPTLMNAALDH1A1
Styrene SCHEMBL164779 0.83 TSHR (0.48) HCAR2ATMKDM4EMAPTLMNA
Ethyl Fumarate SCHEMBL250119 0.82 HCAR2 (0.57) HCAR2ATMKDM4EMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088544-B2 Core-shell polymer nanoparticles and method of making emulsion aggregation particles using same XEROX CORPORATION (US) 2012-01-03 US claimed
US-7208257-B2 Electron beam curable toners and processes thereof XEROX CORPORATION (US) 2007-04-24 US claimed
US-20050287464-A1 Electron beam curable toners and processes thereof XEROX CORPORATION 2005-12-29 US claimed
EP-1610186-B1 Image forming process XEROX CORP (US) 2011-01-05 EP disclosed
US-7208257-B2 Electron beam curable toners and processes thereof XEROX CORPORATION (US) 2007-04-24 US disclosed
US-20050287464-A1 Electron beam curable toners and processes thereof XEROX CORPORATION 2005-12-29 US disclosed
EP-1610186-A2 Electron beam curable toners and processes thereof Xerox Corporation (US) 2005-12-28 EP disclosed