SCHEMBL5571046

SCHEMBL5571046

CN(C)Cc1cc(CC(C)(C)C)c(O)c(CC(C)(C)C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
TSHR P16473 3/20 0.56
ALOX15 P16050 2/20 0.56
GAA P10253 2/20 0.56
LMNA P02545 2/20 0.56
CYP2C9 P11712 2/20 0.56
HSD17B10 Q99714 1/20 0.56
CYP2C19 P33261 3/20 0.52
MAPK1 P28482 2/20 0.52
HTT P42858 2/20 0.52
GSR P00390 1/20 0.47
MAPT P10636 3/20 0.42
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
THRB P10828 1/20 0.42
G6PD P11413 1/20 0.42
PABPC1 P11940 1/20 0.42
KMT2A Q03164 1/20 0.42
HKDC1 Q2TB90 1/20 0.42

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
SCHEMBL28273434 0.81 HSD17B10 (0.80) ALDH1A1TSHRALOX15GAALMNA
SCHEMBL36297 0.81 HSD17B10 (0.80) ALDH1A1TSHRALOX15GAALMNA
SCHEMBL5865868 0.81 ESR1 (0.48) ALDH1A1TSHRALOX15GAALMNA
SCHEMBL25305838 0.79 HSD17B10 (0.77) ALDH1A1TSHRALOX15GAALMNA
Ammonia Solution, Strong SCHEMBL4827174 0.79 HSD17B10 (0.77) ALDH1A1TSHRALOX15GAALMNA
SCHEMBL25306052 0.79 HSD17B10 (0.77) ALDH1A1TSHRALOX15GAALMNA
SCHEMBL9250665 0.79 HSD17B10 (0.77) ALDH1A1TSHRALOX15GAALMNA
SCHEMBL5573027 0.78 ALOX15 (0.62) ALDH1A1TSHRALOX15GAALMNA
Dimethylamine SCHEMBL28105045 0.76 HSD17B10 (0.71) ALDH1A1TSHRALOX15GAALMNA
SCHEMBL5827515 0.74 ESR1 (0.38) ALDH1A1TSHRALOX15LMNACYP2C9

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030040594-A1 Stabilizing high-vinyl polybutadiene BRIDGESTONE CORP. 2003-02-27 US claimed
US-20220153885-A1 PROCESS FOR PRODUCING FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2022-05-19 US disclosed
CN-109415457-B Method for preparing functionalized polymers 株式会社普利司通 2021-05-25 CN disclosed
EP-3458488-B1 PROCESS FOR PRODUCING FUNCTIONALIZED POLYMERS BRIDGESTONE CORP (JP) 2020-12-30 EP disclosed
US-20190185598-A1 Process For Producing Functionalized Polymers BRIDGESTONE CORPORATION (JP) 2019-06-20 US disclosed
EP-3458488-A1 PROCESS FOR PRODUCING FUNCTIONALIZED POLYMERS Bridgestone Corporation (JP) 2019-03-27 EP disclosed
WO-2017201397-A1 PROCESS FOR PRODUCING FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2017-11-23 WO disclosed
US-7211619-B2 Stabilizing high-vinyl polybutadiene BRIDGESTONE CORPORATION (JP) 2007-05-01 US disclosed
US-20030040594-A1 Stabilizing high-vinyl polybutadiene BRIDGESTONE CORP. 2003-02-27 US disclosed