SCHEMBL14967795

SCHEMBL14967795

O=C(OC1CCCCC1)C1OC12CCCC2

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.45
FABP7 O15540 1/20 0.39
FABP5 Q01469 1/20 0.39
EPHX1 P07099 2/20 0.38
NAAA Q02083 2/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HTT P42858 1/20 0.33
CHRM3 P20309 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP19A1 P11511 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MMP1 P03956 1/20 0.30
MMP9 P14780 1/20 0.30
MMP12 P39900 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
SCHEMBL14967049 1.00 CYP2C19 (0.45) CYP2C19FABP7FABP5EPHX1NAAA
SCHEMBL14968303 1.00 CYP2C19 (0.45) CYP2C19FABP7FABP5EPHX1NAAA
SCHEMBL14967881 0.98 CYP2C19 (0.42) CYP2C19FABP7FABP5EPHX1NAAA
SCHEMBL14966929 0.96 CYP2C19 (0.41) CYP2C19FABP7FABP5EPHX1NAAA
SCHEMBL14967426 0.96 CYP2C19 (0.41) CYP2C19FABP7FABP5EPHX1NAAA
SCHEMBL14967571 0.95 CYP2C19 (0.39) CYP2C19FABP7FABP5EPHX1CHRM3
SCHEMBL14967495 0.95 CYP2C19 (0.39) CYP2C19FABP7FABP5EPHX1CHRM3
SCHEMBL16109512 0.95 CYP2C19 (0.39) CYP2C19FABP7FABP5EPHX1NAAA
SCHEMBL14968328 0.93 CYP2C19 (0.36) CYP2C19FABP7FABP5CHRM3ALDH1A1
SCHEMBL16109860 0.91 CYP2C19 (0.35) CYP2C19FABP7FABP5EPHX1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10301397-B2 Method for producing polydienes and polydiene copolymers with reduced cold flow BRIDGESTONE CORPORATION (JP) 2019-05-28 US claimed
US-20160340447-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW BRIDGESTONE CORPORATION (JP) 2016-11-24 US claimed
US-10301397-B2 Method for producing polydienes and polydiene copolymers with reduced cold flow BRIDGESTONE CORPORATION (JP) 2019-05-28 US disclosed
US-20160340447-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW BRIDGESTONE CORPORATION (JP) 2016-11-24 US disclosed
US-9458270-B2 Method for producing polydienes and polydiene copolymers with reduced cold flow BRIDGESTONE CORPORATION (JP) 2016-10-04 US disclosed
EP-2780177-B1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW BRIDGESTONE CORP (JP) 2016-03-23 EP disclosed
US-20140296445-A1 Method For Producing Polydienes And Polydiene Copolymers With Reduced Cold Flow BRIDGESTONE CORPORATION (JP) 2014-10-02 US disclosed
EP-2780177-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW Bridgestone Corporation (JP) 2014-09-24 EP disclosed
WO-2013075074-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW BRIDGESTONE CORPORATION (JP) 2013-05-23 WO disclosed