SCHEMBL28279377

SCHEMBL28279377

CCCCCOC(=O)CC(C)OC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.51
TSHR P16473 4/20 0.50
TP53 P04637 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPK1 P28482 1/20 0.50
LMNA P02545 4/20 0.49
ALDH1A1 P00352 4/20 0.49
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CNR2 P34972 1/20 0.46
MAPT P10636 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL28278500 0.96 TSHR (0.52) TDP1TSHRTP53CYP3A4MAPK1
SCHEMBL28279423 0.87 ALDH1A1 (0.51) TDP1TSHRTP53CYP3A4MAPK1
SCHEMBL28279426 0.85 TSHR (0.52) TDP1TSHRTP53CYP3A4MAPK1
SCHEMBL888349 0.84 NPC1 (0.50) TSHRTP53LMNAALDH1A1NPC1
SCHEMBL28278024 0.83 MEN1 (0.51) TDP1TSHRTP53CYP3A4MAPK1
SCHEMBL5085855 0.83 LMNA (0.48) TDP1TSHRTP53CYP3A4MAPK1
SCHEMBL28279408 0.83 TSHR (0.50) TDP1TSHRTP53CYP3A4MAPK1
SCHEMBL28279355 0.82 MEN1 (0.50) TDP1TSHRTP53CYP3A4MAPK1
SCHEMBL28279363 0.81 TSHR (0.51) TDP1TSHRTP53CYP3A4MAPK1
SCHEMBL888507 0.80 ALDH1A1 (0.50) TDP1TSHRTP53LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109553705-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-04-13 CN claimed
CN-109553712-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-03-16 CN claimed
CN-109553712-A A kind of catalytic component and its catalyst for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 CN claimed
CN-109553705-A A kind of catalytic component and preparation method thereof for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 CN claimed
CN-109553705-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-04-13 CN disclosed
CN-109553712-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-03-16 CN disclosed
CN-109553712-A A kind of catalytic component and its catalyst for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 CN disclosed
CN-109553705-A A kind of catalytic component and preparation method thereof for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 CN disclosed