SCHEMBL14967472

SCHEMBL14967472

CCC1(C(=O)OC2CCCCC2)OC12CCCC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.43
EPHX1 P07099 2/20 0.41
NAAA Q02083 2/20 0.39
MAPT P10636 1/20 0.36
HTT P42858 3/20 0.35
CHRM3 P20309 2/20 0.34
CYP3A4 P08684 2/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
ABCB11 O95342 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CYP2D6 P10635 1/20 0.33
CHRM1 P11229 1/20 0.33
CYP2C9 P11712 1/20 0.33
DRD1 P21728 1/20 0.33
HRH2 P25021 1/20 0.33

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
SCHEMBL14967391 1.00 CYP2C19 (0.43) CYP2C19EPHX1NAAAMAPTHTT
SCHEMBL14966566 1.00 CYP2C19 (0.43) CYP2C19EPHX1NAAAMAPTHTT
SCHEMBL14967608 0.98 CYP2C19 (0.41) CYP2C19EPHX1NAAAMAPTHTT
SCHEMBL14968117 0.97 CYP2C19 (0.40) CYP2C19EPHX1NAAAMAPTHTT
SCHEMBL14967530 0.97 EPHX1 (0.41) CYP2C19EPHX1NAAAMAPTHTT
SCHEMBL14967464 0.95 CYP2C19 (0.37) CYP2C19EPHX1NAAAMAPTCHRM3
SCHEMBL14968253 0.95 CYP2C19 (0.37) CYP2C19EPHX1NAAAMAPTCHRM3
SCHEMBL14966811 0.95 EPHX1 (0.39) CYP2C19EPHX1NAAAMAPTHTT
SCHEMBL14966953 0.94 CYP2C19 (0.35) CYP2C19EPHX1NAAAMAPTCHRM3
SCHEMBL14968216 0.92 EPHX1 (0.36) CYP2C19EPHX1NAAA

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