SCHEMBL3672951

SCHEMBL3672951

CC(=O)OC1CCC=C(C)CCC1OC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R46 P59540 6/20 0.41
LMNA P02545 2/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
PGGT1B P53609 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
RECQL P46063 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TERT O14746 1/20 0.37
PKM P14618 1/20 0.37
CHRM2 P08172 4/20 0.36
CHRM1 P11229 2/20 0.36
CYP2D6 P10635 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM3 P20309 1/20 0.36
EPAS1 Q99814 1/20 0.35
MET P08581 1/20 0.35

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
SCHEMBL3672947 1.00 TAS2R46 (0.41) TAS2R46LMNACYP3A4ALOX15FNTA
SCHEMBL3672216 0.88 TAS2R46 (0.39) TAS2R46LMNACYP3A4ALOX15FNTA
SCHEMBL3672219 0.88 TAS2R46 (0.39) TAS2R46LMNACYP3A4ALOX15FNTA
SCHEMBL3677768 0.88 TAS2R46 (0.39) TAS2R46LMNACYP3A4ALOX15FNTA
SCHEMBL3677766 0.88 TAS2R46 (0.39) TAS2R46LMNACYP3A4ALOX15FNTA
SCHEMBL3680995 0.83 PTPN1 (0.38) TAS2R46LMNACYP3A4ALOX15MEN1
SCHEMBL3680997 0.83 PTPN1 (0.38) TAS2R46LMNACYP3A4ALOX15MEN1
SCHEMBL28030332 0.80 TAS2R46 (0.39) TAS2R46LMNAALOX15MEN1KMT2A
SCHEMBL3673225 0.77 TAS2R46 (0.35) TAS2R46LMNACYP3A4ALOX15FNTA
SCHEMBL3680367 0.77 TAS2R46 (0.38) TAS2R46LMNACYP3A4ALOX15MEN1

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