SCHEMBL3675769

SCHEMBL3675769

CC(=O)OC1CC=CCCC1OC(C)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 5/20 0.40
CHRM1 P11229 3/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
CYP2D6 P10635 1/20 0.40
GSR P00390 2/20 0.39
CHRM4 P08173 2/20 0.37
CHRM3 P20309 2/20 0.37
TSHR P16473 2/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC18A3 Q16572 2/20 0.33
MAPT P10636 2/20 0.32
ALDH1A1 P00352 2/20 0.31
ALOX15 P16050 2/20 0.31
HTT P42858 1/20 0.31
ESR2 Q92731 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL2534761 0.94 CHRM2 (0.44) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL2534764 0.94 CHRM2 (0.44) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL3683003 0.90 CHRM2 (0.38) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL3683001 0.90 CHRM2 (0.38) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL14354717 0.89 CHRM2 (0.42) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL10670131 0.85 CHRM2 (0.41) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL3682857 0.82 CHRM2 (0.39) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL3682859 0.82 CHRM2 (0.39) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL3669571 0.80 SMN1; SMN2 (0.40) KMT2AMEN1GSRTSHRLMNA
SCHEMBL16250340 0.80 GSR (0.53) CHRM2CHRM1KMT2AMEN1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723423-B2 Gas-barrier resin composition CRYOVAC, INC. (US) 2010-05-25 US disclosed
EP-1746131-B1 Gas-barrier resin composition CRYOVAC INC (US) 2009-01-21 EP disclosed
US-7285598-B2 Polymer and process for producing the same KURARAY CO., LTD. (JP) 2007-10-23 US disclosed
US-20070093599-A1 Gas-barrier resin composition CRYOVAC, INC. (US) 2007-04-26 US disclosed
US-20070021556-A1 Gas-barrier resin composition KURARAY CO. LTD. (JP) 2007-01-25 US disclosed
EP-1746131-A2 Gas-barrier resin composition Cryovac, Inc. (US) 2007-01-24 EP disclosed
US-20060149009-A1 Produced by ring-opening, in the presence of a metal alkylidene complex comprising a ligand with an imidazolidine structure, a cyclic olefin comprising at least one cyclic olefin further comprising a hydroxy group or a functional group that can be converted into a hydroxy group, and hydrogenating KURARAY CO., LTD. (JP) 2006-07-06 US disclosed
EP-1598384-A1 NOVEL POLYMER AND PROCESS FOR PRODUCING THE SAME KURARAY CO., LTD. (JP) 2005-11-23 EP disclosed