SCHEMBL2052864

SCHEMBL2052864

C=CCC1(C/C=C/C)C(=O)NN(Cc2ccccc2)C1=O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.37
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 2/20 0.34
CYP2C19 P33261 3/20 0.34
POLB P06746 2/20 0.33
PGR P06401 1/20 0.33
CTSG P08311 1/20 0.32
PRTN3 P24158 1/20 0.32
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
GAA P10253 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NOD1 Q9Y239 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
SCHEMBL2052865 1.00 ELANE (0.37) ELANENPSR1HPGDCYP2C19POLB
SCHEMBL2051025 0.91 ELANE (0.40) ELANENPSR1HPGDCYP2C19POLB
SCHEMBL2045783 0.83 CYP2C19 (0.47) ELANENPSR1HPGDCYP2C19CTSG
SCHEMBL2045781 0.83 CYP2C19 (0.47) ELANENPSR1HPGDCYP2C19CTSG
SCHEMBL2050387 0.81 ELANE (0.41) ELANENPSR1HPGDCYP2C19POLB
SCHEMBL2050388 0.81 ELANE (0.41) ELANENPSR1HPGDCYP2C19POLB
SCHEMBL2045522 0.80 PGR (0.34) ELANECYP2C19PGRKMT2AMEN1
SCHEMBL2045521 0.80 PGR (0.34) ELANECYP2C19PGRKMT2AMEN1
SCHEMBL2047241 0.79 NPSR1 (0.57) ELANENPSR1CYP2C19POLBCTSG
SCHEMBL2047243 0.79 NPSR1 (0.57) ELANENPSR1CYP2C19POLBCTSG

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
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
WO-2009038031-A1 BLOCK COPOLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-26 WO 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