SCHEMBL16110628

SCHEMBL16110628

COc1ccc(C2OC2(C)C(=O)OC2CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 4/20 0.43
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
SLC6A2 P23975 1/20 0.40
OPRK1 P41145 1/20 0.39
GAA P10253 2/20 0.38
HSD17B10 Q99714 2/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 2/20 0.37
TSHR P16473 1/20 0.37
RECQL P46063 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
ELANE P08246 1/20 0.37
CTSG P08311 1/20 0.37
PRTN3 P24158 1/20 0.37
DDB1 Q16531 1/20 0.37

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
SCHEMBL14968168 0.95 ALDH1A1 (0.41) MEN1KMT2AALDH1A1SLC6A4SLC6A3
SCHEMBL16109534 0.95 SLC6A4 (0.42) MEN1KMT2AALDH1A1SLC6A4SLC6A3
SCHEMBL16109080 0.93 TP53 (0.41) MEN1KMT2AALDH1A1SLC6A4SLC6A3
SCHEMBL16109514 0.87 OPRK1 (0.46) ALDH1A1OPRK1GAAHSD17B10RAB9A
SCHEMBL16108686 0.86 SCN1A (0.38) MEN1KMT2AALDH1A1SLC6A4SLC6A3
SCHEMBL14967810 0.84 CHRM3 (0.39) MEN1KMT2AALDH1A1GAAHSD17B10
SCHEMBL16108809 0.83 KMT2A (0.41) MEN1KMT2AALDH1A1SLC6A4SLC6A3
SCHEMBL16108680 0.82 ALDH1A1 (0.50) MEN1KMT2AALDH1A1GAAHSD17B10
SCHEMBL14968007 0.81 MEN1 (0.44) MEN1KMT2AALDH1A1SLC6A4SLC6A3
SCHEMBL16109509 0.81 TP53 (0.39) MEN1KMT2AALDH1A1SLC6A4SLC6A3

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 4 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
US-20140296445-A1 Method For Producing Polydienes And Polydiene Copolymers With Reduced Cold Flow BRIDGESTONE CORPORATION (JP) 2014-10-02 US disclosed