SCHEMBL3673877

SCHEMBL3673877

COC(=O)OC1C/C=C\CCCC1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
ALDH1A1 P00352 1/20 0.34
ACACB O00763 5/20 0.33
CYP19A1 P11511 1/20 0.33
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.31
NAAA Q02083 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NPC1 O15118 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 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
SCHEMBL3673884 1.00 EPHX1 (0.36) EPHX1SMN1; SMN2LMNATP53TSHR
SCHEMBL3678106 0.95 LMNA (0.36) EPHX1SMN1; SMN2LMNATP53TSHR
SCHEMBL5430000 0.89 SMN1; SMN2 (0.40) EPHX1SMN1; SMN2LMNATP53TSHR
SCHEMBL3677550 0.82 ALDH1A1 (0.33) SMN1; SMN2LMNATP53TSHRALDH1A1
SCHEMBL31490424 0.81 EPHX1 (0.38) EPHX1SMN1; SMN2LMNATP53TSHR
SCHEMBL3678399 0.81 EPHX1 (0.34) EPHX1ALDH1A1CYP19A1KMT2ANAAA
SCHEMBL3678402 0.81 EPHX1 (0.34) EPHX1ALDH1A1CYP19A1KMT2ANAAA
SCHEMBL756915 0.81 EPHX1 (0.38) EPHX1SMN1; SMN2LMNATP53TSHR
SCHEMBL1628386 0.81 EPHX1 (0.38) EPHX1SMN1; SMN2LMNATP53TSHR
SCHEMBL25497683 0.81 EPHX1 (0.42) EPHX1SMN1; SMN2LMNATP53TSHR

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