SCHEMBL3678418

SCHEMBL3678418

CC1=CCCC(O)C(C)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
TAS2R46 P59540 8/20 0.38
LMNA P02545 3/20 0.37
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CNR2 P34972 1/20 0.35
PPARA Q07869 1/20 0.35
STAT3 P40763 2/20 0.33
MET P08581 1/20 0.33
TAS2R31 P59538 2/20 0.33
TAS2R10 Q9NYW0 2/20 0.33
CYP3A4 P08684 2/20 0.31
ALOX15 P16050 2/20 0.31
MAPK1 P28482 1/20 0.31
CHRNA7 P36544 1/20 0.31
RECQL P46063 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TERT O14746 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
SCHEMBL3678415 1.00 CA1 (0.39) CA1CA2CA4TAS2R46LMNA
SCHEMBL13209084 0.96 TAS2R46 (0.40) CA1CA2CA4TAS2R46LMNA
SCHEMBL13209083 0.92 CA1 (0.39) CA1CA2CA4TAS2R46LMNA
SCHEMBL3671287 0.92 CA1 (0.39) CA1CA2CA4TAS2R46LMNA
SCHEMBL3671290 0.92 CA1 (0.39) CA1CA2CA4TAS2R46LMNA
SCHEMBL13209302 0.92 CA1 (0.39) CA1CA2CA4TAS2R46LMNA
SCHEMBL13209448 0.88 TAS2R46 (0.40) CA1CA2CA4TAS2R46LMNA
SCHEMBL3677652 0.85 LMNA (0.41) TAS2R46LMNAMEN1KMT2ACNR2
SCHEMBL3677651 0.85 LMNA (0.41) TAS2R46LMNAMEN1KMT2ACNR2
SCHEMBL13209299 0.78 CA1 (0.36) CA1CA2CA4TAS2R46

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