SCHEMBL3670092

SCHEMBL3670092

CC(=O)OC1CC=C(C)CCCC1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAS2R46 P59540 2/20 0.40
LMNA P02545 3/20 0.39
CYP3A4 P08684 3/20 0.36
ALOX15 P16050 2/20 0.36
TSHR P16473 2/20 0.36
TDP1 Q9NUW8 2/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
USP2 O75604 1/20 0.34
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.33
CASP6 P55212 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
CYP19A1 P11511 5/20 0.32
CYP17A1 P05093 1/20 0.32
DPP4 P27487 1/20 0.32

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
SCHEMBL3670091 1.00 TAS2R46 (0.40) TAS2R46LMNACYP3A4ALOX15TSHR
SCHEMBL16943992 0.88 LMNA (0.46) TAS2R46LMNACYP3A4ALOX15TSHR
SCHEMBL7736948 0.88 LMNA (0.46) TAS2R46LMNACYP3A4ALOX15TSHR
SCHEMBL3673848 0.84 PTPN1 (0.37) LMNATSHRTDP1USP2NPC1
SCHEMBL3673845 0.84 PTPN1 (0.37) LMNATSHRTDP1USP2NPC1
SCHEMBL3673221 0.81 TAS2R46 (0.35) TAS2R46LMNACYP3A4ALOX15TSHR
SCHEMBL3673225 0.81 TAS2R46 (0.35) TAS2R46LMNACYP3A4ALOX15TSHR
SCHEMBL3680367 0.78 TAS2R46 (0.38) TAS2R46LMNACYP3A4ALOX15TDP1
SCHEMBL3680369 0.78 TAS2R46 (0.38) TAS2R46LMNACYP3A4ALOX15TDP1
SCHEMBL3672374 0.77 TAS2R46 (0.42) TAS2R46LMNACYP3A4ALOX15TSHR

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