SCHEMBL2049720

SCHEMBL2049720

C=CCC1(CC=C)C(=O)N(CCC)N(CCC)C1=O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 1/20 0.37
MMP9 P14780 1/20 0.34
PDE4A P27815 2/20 0.31
ADORA2A P29274 2/20 0.31
ADORA2B P29275 2/20 0.31
PDE4B Q07343 2/20 0.31
PDE4C Q08493 2/20 0.31
PDE4D Q08499 2/20 0.31
PGR P06401 1/20 0.31

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
SCHEMBL2045115 0.89 CPT1A (0.42) CPT1AMMP9
SCHEMBL2050946 0.85 CPT1A (0.47) CPT1A
SCHEMBL2047149 0.83 CPT1A (0.36) CPT1AMMP9PGR
SCHEMBL2050980 0.81 CPT1A (0.36) CPT1AMMP9PDE4AADORA2AADORA2B
SCHEMBL2047416 0.79 CPT1A (0.34) CPT1AMMP9PGR
SCHEMBL2047089 0.75 ALDH1A1 (0.40) CPT1APGR
SCHEMBL2051465 0.74 MMP9 (0.33) CPT1AMMP9PGR
SCHEMBL2049233 0.74 CPT1A (0.30) CPT1APGR
SCHEMBL2045687 0.74 CPT1A (0.40) CPT1A
SCHEMBL2044822 0.72 ELANE (0.46) CPT1AMMP9PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964691-B2 5,5-diallyl-2,2-dimethyl-1,3-dioxane as monomer units; polymerization catalysts; heat resistance SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-21 US disclosed
US-20080214755-A1 OLEFIN-DIENE COPOLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-04 US disclosed
US-20080214754-A1 DIENE POLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-04 US disclosed