SCHEMBL2189441

SCHEMBL2189441

CC(=CCCCNC(N)=O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
HIF1A Q16665 1/20 0.34
PAOX Q6QHF9 2/20 0.33
CD81 P60033 1/20 0.33
ADRA1A P35348 1/20 0.32
EP300 Q09472 1/20 0.32
TBXAS1 P24557 1/20 0.32
EPHX2 P34913 1/20 0.31
ALOX15 P16050 1/20 0.31
GRIK1 P39086 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL472249 0.89 CD81 (0.35) CD81CYP2C9
SCHEMBL875497 0.89 CD81 (0.35) CD81CYP2C9
SCHEMBL9841124 0.85 KDM4E (0.52) KDM4EMAPK1HIF1APAOXCD81
SCHEMBL9841122 0.85 KDM4E (0.52) KDM4EMAPK1HIF1APAOXCD81
SCHEMBL2110802 0.80 MEN1 (0.36) KDM4EMAPK1HIF1ACD81ADRA1A
SCHEMBL4497690 0.79 CD81 (0.39) CD81EP300TBXAS1
SCHEMBL637283 0.79 CD81 (0.36) KDM4ECD81EP300TBXAS1
SCHEMBL637285 0.79 CD81 (0.36) KDM4ECD81EP300TBXAS1
SCHEMBL2497944 0.78 PAOX (0.42) KDM4EPAOXCD81ALOX15
SCHEMBL1317424 0.77 EP300 (0.48) CD81EP300TBXAS1GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2342079-B1 USE OF COMPOSITE FILMS AS A PACKAGING MATERIAL FOR OXIDATION-SENSITIVE POLYMERS, METHOD FOR PACKAGING OXIDATION-SENSITIVE POLYMERS, AND PACKAGING FORMS CONTAINING SAID COMPOSITE FILMS BASF SE (DE) 2018-06-20 EP disclosed
US-20110220534-A1 USE OF COMPOSITE FILMS AS A PACKAGING MATERIAL FOR OXIDATION-SENSITIVE POLYMERS, METHOD FOR PACKAGING OXIDATION-SENSITIVE POLYMERS, AND PACKAGING CONTAINING SAID COMPOSITE FILMS BASF SE (DE) 2011-09-15 US disclosed
EP-2342079-A1 USE OF COMPOSITE FILMS AS A PACKAGING MATERIAL FOR OXIDATION-SENSITIVE POLYMERS, METHOD FOR PACKAGING OXIDATION-SENSITIVE POLYMERS, AND PACKAGING FORMS CONTAINING SAID COMPOSITE FILMS BASF SE (DE) 2011-07-13 EP disclosed
WO-2010052088-A1 USE OF COMPOSITE FILMS AS A PACKAGING MATERIAL FOR OXIDATION-SENSITIVE POLYMERS, METHOD FOR PACKAGING OXIDATION-SENSITIVE POLYMERS, AND PACKAGING FORMS CONTAINING SAID COMPOSITE FILMS BASF SE (DE) 2010-05-14 WO disclosed