SCHEMBL28278397

SCHEMBL28278397

CCCCCOC(=O)C1CCCCC1OC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM5 P08912 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KCNH2 Q12809 1/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
PPARG P37231 3/20 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
SCHEMBL28278041 0.98 CHRM2 (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL28279402 0.96 KCNH2 (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL28279416 0.94 KCNH2 (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL28278032 0.91 LMNA (0.54) CHRM2CHRM4CHRM1CHRM3KCNH2
SCHEMBL28279362 0.89 LMNA (0.54) CHRM2CHRM4CHRM1CHRM3KCNH2
SCHEMBL28278031 0.86 KCNH2 (0.55) CHRM2CHRM4CHRM1CHRM3KCNH2
SCHEMBL28537112 0.84 LMNA (0.42) CYP3A4TSHRMAPK1
SCHEMBL28277997 0.84 KCNH2 (0.55) CHRM2CHRM4CHRM1CHRM3KCNH2
SCHEMBL28279411 0.78 PPARG (0.49) TDP1KCNH2TP53CYP3A4TSHR
SCHEMBL16347173 0.78 TSHR (0.52) CHRM2CHRM4CHRM5CHRM1CHRM3

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 6 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