SCHEMBL3672027

SCHEMBL3672027

CC(=O)OC1C=CCC1OC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.39
HK1 P19367 1/20 0.39
HKDC1 Q2TB90 1/20 0.39
CHRM2 P08172 5/20 0.36
CHRM1 P11229 3/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CYP2D6 P10635 1/20 0.36
CHRM4 P08173 2/20 0.33
CHRM3 P20309 2/20 0.33
CA12 O43570 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
CA1 P00915 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL7522735 0.84 CHRM2 (0.38) NSD2HK1HKDC1CHRM2CHRM1
SCHEMBL7522732 0.84 CHRM2 (0.38) NSD2HK1HKDC1CHRM2CHRM1
SCHEMBL10478262 0.84 CHRM2 (0.38) NSD2HK1HKDC1CHRM2CHRM1
SCHEMBL14354717 0.80 CHRM2 (0.42) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL3677890 0.77 CHRM2 (0.37) NSD2HK1HKDC1CHRM2CHRM1
SCHEMBL13606433 0.76 NSD2 (0.37) NSD2HK1HKDC1CA12CA2
SCHEMBL3675276 0.76
SCHEMBL3672453 0.76 SLC18A3 (0.38) NSD2HK1HKDC1CHRM2CHRM1
SCHEMBL3672454 0.76 SLC18A3 (0.38) NSD2HK1HKDC1CHRM2CHRM1
SCHEMBL29964219 0.72 CHRM2 (0.32) 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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101679198-B Method for isomerizing allyl compounds MITSUBISHI CHEM CORP 2014-07-09 CN disclosed
US-7723423-B2 Gas-barrier resin composition CRYOVAC, INC. (US) 2010-05-25 US disclosed
CN-101679198-A Method for isomerizing allyl compounds MITSUBISHI CHEM CORP 2010-03-24 CN disclosed
CN-101641437-A Isoforms of pig liver esterase EVONIK DEGUSSA GMBH DE 2010-02-03 CN 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
US-6559241-B2 Process for producing a hydrogenated polymer KURARAY CO., LTD. (JP) 2003-05-06 US disclosed
US-20020137854-A1 Process for producing a hydrogenated polymer KURARAY CO. LTD. (JP) 2002-09-26 US disclosed
EP-1241189-A1 Process for producing a hydrogenated polymer KURARAY CO., LTD. (JP) 2002-09-18 EP disclosed
US-5113014-A PROCESSES FOR PREPARING PROSTAGLANDINS YALE UNIVERSITY (US) 1992-05-12 US disclosed
WO-1991009012-A1 PROCESSES FOR PREPARING PROSTAGLANDINS YALE UNIVERSITY (US) 1991-06-27 WO disclosed
US-4001308-A REACTION OF DIBROMO COMPOUND WITH METAL SALT OF ACETIC ACID TEIJIN LIMITED (JA) 1977-01-04 US disclosed