SCHEMBL16110596

SCHEMBL16110596

CCC1(C(=O)OC(C)(C)C)OC1c1ccc(C)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 2/20 0.33
GPR119 Q8TDV5 1/20 0.33
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
ALOX12 P18054 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CACNA1D Q01668 2/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.30
ABCC1 P33527 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
SCHEMBL14967029 0.86 ALDH1A1 (0.39) ALDH1A1LMNASMN1; SMN2HPGDKMT2A
SCHEMBL14967634 0.84 OPRM1 (0.39) ALDH1A1LMNAALOX12SMN1; SMN2CACNA1D
SCHEMBL14968220 0.84 CYP3A4 (0.36) ALDH1A1LMNAALOX12SMN1; SMN2CACNA1D
SCHEMBL16108695 0.81 GPR119 (0.35) ADORA2BGPR119ALDH1A1LMNAALOX12
SCHEMBL14967023 0.81 ABHD10 (0.41) ADORA2BALDH1A1LMNAALOX12SMN1; SMN2
SCHEMBL14966700 0.81 ALDH1A1 (0.34) ADORA2BALDH1A1LMNAALOX12SMN1; SMN2
SCHEMBL14967843 0.80 SCN1A (0.36) ALDH1A1LMNAALOX12SMN1; SMN2CACNA1D
SCHEMBL14967685 0.78 TSHR (0.37) ALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL14967334 0.78 USP2 (0.39) LMNACACNA1D
SCHEMBL14967613 0.77 CHRNA1 (0.37) ADORA2BALDH1A1SMN1; SMN2HPGDKMT2A

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 5 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