SCHEMBL2047477

SCHEMBL2047477

C=CCC1(CC=CCCCC)C(=O)c2ccccc2C1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 1/20 0.35
PGR P06401 2/20 0.34
PTGS2 P35354 1/20 0.33
SOAT2 O75908 1/20 0.33
SOAT1 P35610 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
CYP2D6 P10635 2/20 0.32
TRPA1 O75762 1/20 0.32
POLM Q9NP87 1/20 0.32
POLK Q9UBT6 1/20 0.32
POLL Q9UGP5 1/20 0.32
POLH Q9Y253 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
FAAH O00519 1/20 0.32
EPHX2 P34913 1/20 0.32
MGLL Q99685 1/20 0.31
BID P55957 2/20 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
SCHEMBL2047475 1.00 CPT1A (0.35) CPT1APGRPTGS2SOAT2SOAT1
SCHEMBL2045778 0.96 CPT1A (0.37) CPT1ASOAT2SOAT1CYP2D6POLM
SCHEMBL2045775 0.96 CPT1A (0.37) CPT1ASOAT2SOAT1CYP2D6POLM
SCHEMBL2046355 0.94 CPT1A (0.39) CPT1ASOAT2SOAT1TSHRCYP2D6
SCHEMBL2046352 0.94 CPT1A (0.39) CPT1ASOAT2SOAT1TSHRCYP2D6
SCHEMBL2047493 0.94 CPT1A (0.39) CPT1ASOAT2SOAT1TSHRCYP2D6
SCHEMBL2047128 0.94 CPT1A (0.39) CPT1ASOAT2SOAT1TSHRCYP2D6
SCHEMBL2052165 0.94 CPT1A (0.39) CPT1ASOAT2SOAT1TSHRCYP2D6
SCHEMBL2047130 0.94 CPT1A (0.39) CPT1ASOAT2SOAT1TSHRCYP2D6
SCHEMBL2050785 0.94 CPT1A (0.39) CPT1ASOAT2SOAT1TSHRCYP2D6

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
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
WO-2009038006-A1 RANDOM COPOLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-26 WO disclosed
US-20080221287-A1 DIENE POLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-11 US disclosed
US-20080214755-A1 OLEFIN-DIENE COPOLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-04 US disclosed