SCHEMBL3677550

SCHEMBL3677550

COC(=O)OC1CC=CC1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
POLB P06746 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 2/20 0.31
TSHR P16473 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
TP53 P04637 1/20 0.31
GAA P10253 1/20 0.30
MEN1 O00255 1/20 0.30
PRNP P04156 1/20 0.30
MAPK10 P53779 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
KCNH2 Q12809 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
SCHEMBL5430000 0.86 SMN1; SMN2 (0.40) ALDH1A1KDM4EHSD17B10TDP1LMNA
SCHEMBL3678106 0.84 LMNA (0.36) ALDH1A1POLBTDP1LMNATSHR
SCHEMBL3673884 0.82 EPHX1 (0.36) ALDH1A1POLBTDP1LMNATSHR
SCHEMBL3673877 0.82 EPHX1 (0.36) ALDH1A1POLBTDP1LMNATSHR
SCHEMBL3682781 0.77 EPHX1 (0.37) ALDH1A1KDM4EHSD17B10TDP1LMNA
SCHEMBL697519 0.77
SCHEMBL1078014 0.77 EPHX1 (0.39) ALDH1A1HSD17B10LMNATSHRSMN1; SMN2
SCHEMBL1079969 0.77 ALDH1A1 (0.33) ALDH1A1TSHRSMN1; SMN2MEN1KMT2A
SCHEMBL880204 0.75
SCHEMBL8012942 0.74 CYP19A1 (0.34) HSD17B10LMNATSHRGAAMEN1

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