SCHEMBL3677424

SCHEMBL3677424

COC(=O)OC1C=CCCCCC1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.35
MAPT P10636 2/20 0.34
RAB9A P51151 4/20 0.34
NPC1 O15118 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
CYP19A1 P11511 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
ALDH1A1 P00352 1/20 0.31
CA12 O43570 2/20 0.30
CA1 P00915 2/20 0.30
CA2 P00918 2/20 0.30
MMP2 P08253 2/20 0.30
CA9 Q16790 2/20 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
SCHEMBL15748145 1.00 EPHX1 (0.35) EPHX1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL3677421 1.00 EPHX1 (0.35) EPHX1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL3677465 0.98 MAPT (0.35) EPHX1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL30557998 0.93 MAPT (0.36) EPHX1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL1149970 0.93 MAPT (0.36) EPHX1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL2097367 0.85 MAPT (0.41) MAPTRAB9ANPC1SMN1; SMN2TSHR
SCHEMBL15747964 0.83 EPHX1 (0.30) EPHX1
SCHEMBL3674320 0.82 CA12 (0.34) EPHX1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL15750117 0.82 CA12 (0.34) EPHX1MAPTRAB9ANPC1SMN1; SMN2
SCHEMBL3674322 0.82 CA12 (0.34) EPHX1MAPTRAB9ANPC1SMN1; SMN2

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