SCHEMBL16110563

SCHEMBL16110563

CCCOC(=O)C1OC1(CC)c1ccc(C)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.34
OPRM1 P35372 1/20 0.34
ADORA2B P29275 4/20 0.34
LMNA P02545 3/20 0.33
POLB P06746 1/20 0.33
ESR1 P03372 1/20 0.33
CHRM1 P11229 1/20 0.33
TSHR P16473 1/20 0.33
SLC6A2 P23975 1/20 0.33
KDR P35968 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAA P10253 2/20 0.32
HPGD P15428 1/20 0.32
ALOX12 P18054 1/20 0.32
PPM1B O75688 1/20 0.32
PTPN1 P18031 1/20 0.32
PPP1CC P36873 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ABHD10 Q9NUJ1 1/20 0.32

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
SCHEMBL16108654 0.92 TSHR (0.37) ALDH1A1LMNAPOLBESR1TSHR
SCHEMBL16109650 0.91 PPARG (0.39) ALDH1A1LMNAESR1TSHRMAPT
SCHEMBL16109613 0.90 LMNA (0.39) ALDH1A1OPRM1LMNAPOLBTSHR
SCHEMBL16109766 0.90 PPARG (0.41) ALDH1A1LMNAPOLBESR1TSHR
SCHEMBL14967754 0.87 LMNA (0.44) ALDH1A1LMNACHRM1TSHRGAA
SCHEMBL14967899 0.86 CHRM2 (0.37) ALDH1A1LMNACHRM1TSHRGAA
SCHEMBL9692237 0.84 TDP1 (0.36) ALDH1A1OPRM1LMNATDP1GAA
SCHEMBL14968341 0.83 ALDH1A1 (0.36) ALDH1A1OPRM1ADORA2BLMNAPOLB
SCHEMBL14967883 0.82 LMNA (0.35) ALDH1A1OPRM1ADORA2BLMNAPOLB
SCHEMBL16110272 0.81 ABHD10 (0.44) ALDH1A1OPRM1ADORA2BLMNATSHR

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