SCHEMBL3672514

SCHEMBL3672514

CC(=O)OC1(C)CCCC=C(C)CC1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 1/20 0.36
CYP19A1 P11511 11/20 0.33
CCR2 P41597 2/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
PGGT1B P53609 1/20 0.32
PTGS1 P23219 1/20 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
SCHEMBL3672511 1.00 CDC25B (0.36) CDC25BCYP19A1CCR2FNTAFNTB
SCHEMBL3675759 0.87 FNTA (0.34) CDC25BCYP19A1FNTAFNTBPGGT1B
SCHEMBL3675756 0.87 FNTA (0.34) CDC25BCYP19A1FNTAFNTBPGGT1B
SCHEMBL3674648 0.84 PTPN1 (0.36) CDC25BCYP19A1CCR2
SCHEMBL3674652 0.84 PTPN1 (0.36) CDC25BCYP19A1CCR2
SCHEMBL11051367 0.75 PTPN1 (0.33)
SCHEMBL11051364 0.75 PTPN1 (0.33)
SCHEMBL1928919 0.74
SCHEMBL135404 0.74 CYP19A1 (0.41) CYP19A1
SCHEMBL3675761 0.74 CYP19A1 (0.34) CYP19A1

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