SCHEMBL3675688

SCHEMBL3675688

C/C1=C/CCC(O)C(C)(O)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.40
PTAFR P25105 8/20 0.37
MET P08581 1/20 0.36
PPARA Q07869 2/20 0.36
MEN1 O00255 1/20 0.36
CNR2 P34972 1/20 0.36
KMT2A Q03164 1/20 0.36
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PTPN2 P17706 2/20 0.35
PTPN1 P18031 2/20 0.35
ESR1 P03372 2/20 0.34
AR P10275 2/20 0.34
ESR2 Q92731 2/20 0.34

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
SCHEMBL3675691 1.00 STAT3 (0.40) STAT3PTAFRMETPPARAMEN1
SCHEMBL3680737 0.85 STAT3 (0.46) STAT3PTAFRMETPPARAMEN1
SCHEMBL3680738 0.85 STAT3 (0.46) STAT3PTAFRMETPPARAMEN1
SCHEMBL3683019 0.70 CYP19A1 (0.33) PTPN2PTPN1
SCHEMBL3683022 0.70 CYP19A1 (0.33) PTPN2PTPN1
SCHEMBL3677651 0.67 LMNA (0.41) STAT3METPPARAMEN1CNR2
SCHEMBL19967514 0.67
SCHEMBL3677652 0.67 LMNA (0.41) STAT3METPPARAMEN1CNR2
SCHEMBL3672771 0.67 PTAFR (0.34) STAT3PTAFRMETPPARAMEN1
SCHEMBL3672776 0.67 PTAFR (0.34) STAT3PTAFRMETPPARAMEN1

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