SCHEMBL14967720

SCHEMBL14967720

Cc1ccc(C2OC2C(=O)OC(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
SLC6A2 P23975 2/20 0.44
SLC6A4 P31645 2/20 0.44
SLC6A3 Q01959 2/20 0.44
CHRNA1 P02708 1/20 0.44
CHRNG P07510 1/20 0.44
ITGA5 P08648 1/20 0.44
CHRNB1 P11230 1/20 0.44
CHRNB2 P17787 1/20 0.44
CHRNB4 P30926 1/20 0.44
CHRNA3 P32297 1/20 0.44
CHRNA4 P43681 1/20 0.44
CHRND Q07001 1/20 0.44
EPHX1 P07099 4/20 0.40
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 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
SCHEMBL14967702 0.87 TSHR (0.61) TSHREPHX1MEN1TP53CYP1A2
SCHEMBL7142138 0.86 SMN1; SMN2 (0.46) TSHRSLC6A2SLC6A4SLC6A3TP53
SCHEMBL7142127 0.86 SMN1; SMN2 (0.46) TSHRSLC6A2SLC6A4SLC6A3TP53
SCHEMBL7906590 0.81 TSHR (0.54) TSHRSLC6A2SLC6A4SLC6A3EPHX1
SCHEMBL7906596 0.81 TSHR (0.54) TSHRSLC6A2SLC6A4SLC6A3EPHX1
SCHEMBL7902731 0.81 TSHR (0.54) TSHRSLC6A2SLC6A4SLC6A3EPHX1
SCHEMBL2210689 0.79 TSHR (0.79) TSHREPHX1MEN1TP53CYP1A2
SCHEMBL14967207 0.77 TSHR (0.50) TSHREPHX1MEN1TP53CYP1A2
SCHEMBL14968033 0.76 TSHR (0.53) TSHRSLC6A2SLC6A4SLC6A3CHRNA1
SCHEMBL14966864 0.76 TSHR (0.56) TSHREPHX1MEN1TP53CYP1A2

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