SCHEMBL16110259

SCHEMBL16110259

CCCCCOC(=O)C1(C)OC1c1ccc(OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
GAA P10253 2/20 0.40
HSD17B10 Q99714 2/20 0.40
MIF P14174 1/20 0.40
LMNA P02545 3/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 4/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 4/20 0.37
MEN1 O00255 2/20 0.37
APAF1 O14727 1/20 0.37
USP2 O75604 1/20 0.37
HSP90AA1 P07900 1/20 0.37
NTSR1 P30989 1/20 0.37
UBE2N P61088 1/20 0.37
POLB P06746 1/20 0.37
STS P08842 1/20 0.36

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
SCHEMBL16109831 0.99 ALDH1A1 (0.40) ALDH1A1GAAHSD17B10MIFLMNA
SCHEMBL16110018 0.97 ALDH1A1 (0.42) ALDH1A1GAAHSD17B10MIFLMNA
SCHEMBL16109042 0.91 ALDH1A1 (0.43) ALDH1A1GAAHSD17B10MIFLMNA
SCHEMBL16110020 0.87 TSHR (0.39) ALDH1A1HSD17B10LMNAKDM4ETSHR
SCHEMBL14967640 0.86 MIF (0.39) ALDH1A1GAAHSD17B10MIFLMNA
SCHEMBL16109900 0.86 HSD17B10 (0.41) ALDH1A1HSD17B10LMNAKDM4ETSHR
SCHEMBL14967137 0.86 PPARG (0.49) ALDH1A1HSD17B10LMNAKDM4ETSHR
SCHEMBL16110561 0.86 TSHR (0.38) ALDH1A1HSD17B10LMNAKDM4ETSHR
SCHEMBL16108680 0.85 ALDH1A1 (0.50) ALDH1A1GAAHSD17B10LMNAKDM4E
SCHEMBL14967890 0.85 MIF (0.39) ALDH1A1GAAHSD17B10MIFLMNA

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