SCHEMBL14968182

SCHEMBL14968182

CCC1OC1C(=O)OC1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.46
NAAA Q02083 2/20 0.42
HTT P42858 2/20 0.38
CYP2C19 P33261 1/20 0.37
CHRM2 P08172 3/20 0.36
CHRM4 P08173 3/20 0.36
CHRM5 P08912 3/20 0.36
CHRM1 P11229 3/20 0.36
CHRM3 P20309 3/20 0.36
FABP7 O15540 1/20 0.35
FABP5 Q01469 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
CYP19A1 P11511 1/20 0.33
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 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
SCHEMBL14967428 0.98 EPHX1 (0.43) EPHX1NAAAHTTCYP2C19CHRM2
SCHEMBL14967381 0.95 EPHX1 (0.40) EPHX1NAAAHTTCYP2C19CHRM2
SCHEMBL14967440 0.91 PPM1B (0.35) EPHX1NAAACYP19A1
SCHEMBL29353235 0.79 EPHX1 (0.45) EPHX1NAAAHTTCYP2C19FABP7
SCHEMBL11194073 0.79 EPHX1 (0.45) EPHX1NAAAHTTCYP2C19FABP7
SCHEMBL11190659 0.79 EPHX1 (0.45) EPHX1NAAAHTTCYP2C19FABP7
SCHEMBL9418746 0.79 SMN1; SMN2 (0.37) EPHX1NAAAHTTCYP2C19CHRM2
SCHEMBL14966797 0.78 EPHX1 (0.43) EPHX1NAAAHTTCYP2C19CHRM2
SCHEMBL8469260 0.77 NAAA (0.50) EPHX1NAAAHTTALDH1A1
SCHEMBL11188748 0.77 EPHX1 (0.42) EPHX1NAAAHTTCYP2C19FABP7

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 7 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 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