SCHEMBL20658014

SCHEMBL20658014

CC(C)O[Si](OC(C)C)(c1cccc2ccccc12)c1cccc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 4/20 0.39
CYP2A6 P11509 4/20 0.39
NR2E1 Q9Y466 2/20 0.37
CYP1A2 P05177 4/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
MAPT P10636 1/20 0.37
HTR1B P28222 2/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
ADRA2A P08913 2/20 0.35
ADRA2B P18089 2/20 0.35
ADRA2C P18825 2/20 0.35
ADRA1A P35348 2/20 0.35
ADRA1D P25100 1/20 0.35
ADRA1B P35368 1/20 0.35
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL29895557 0.85 KDM4E (0.39) KDM4EALDH1A1CYP2A6NR2E1CYP1A2
SCHEMBL108035 0.85 KDM4E (0.39) KDM4EALDH1A1CYP2A6NR2E1CYP1A2
SCHEMBL29404894 0.78 CYP2A6 (0.43) KDM4EALDH1A1CYP2A6CYP1A2CYP2C19
SCHEMBL5043689 0.78 CYP2A6 (0.43) KDM4EALDH1A1CYP2A6CYP1A2CYP2C19
SCHEMBL2550554 0.75 HPRT1 (0.47) KDM4EALDH1A1CYP2A6NR2E1CYP1A2
SCHEMBL26259237 0.74 ALDH1A1 (0.43) ALDH1A1CYP2A6CYP1A2CYP2C9CYP2C19
SCHEMBL29404268 0.73 HPGD (0.40) KDM4EALDH1A1CYP2A6CYP1A2CYP2C19
SCHEMBL5050571 0.73 HPGD (0.40) KDM4EALDH1A1CYP2A6CYP1A2CYP2C19
SCHEMBL31001725 0.72 ALDH1A1 (0.38) KDM4EALDH1A1CYP2A6CYP1A2CYP2C19
SCHEMBL15066695 0.72 ALDH1A1 (0.38) KDM4EALDH1A1CYP2A6CYP1A2CYP2C19

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
CN-108473684-B Process for producing siloxane polymer 东丽精细化工株式会社 2023-05-12 CN disclosed
US-10647821-B2 Production process for silicone polymer TORAY FINE CHEMICALS CO., LTD. (JP) 2020-05-12 US disclosed
US-20190023848-A1 PRODUCTION PROCESS FOR SILICONE POLYMER TORAY FINE CHEMICALS CO., LTD. (JP) 2019-01-24 US disclosed
CN-108473684-A The manufacturing method of siloxane polymer 东丽精细化工株式会社 2018-08-31 CN disclosed