SCHEMBL28547231

SCHEMBL28547231

CCCC(=O)OC(=O)OC(=O)c1ccccc1CC

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
LMNA P02545 2/20 0.42
F2R P25116 1/20 0.42
TSHR P16473 4/20 0.40
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP4F2 P78329 2/20 0.39
CYP4A11 Q02928 2/20 0.39
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 2/20 0.37
UTS2R Q9UKP6 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
RECQL P46063 1/20 0.37
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL28547736 0.91 ALDH1A1 (0.47) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL28537035 0.89 TSHR (0.43) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL28551387 0.82 ALDH1A1 (0.45) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL7257515 0.81 ALDH1A1 (0.55) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL28554559 0.81 ALDH1A1 (0.45) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL739158 0.81 TSHR (0.52) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL28543776 0.81 LMNA (0.46) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL27749477 0.80 ALDH1A1 (0.50) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL27770565 0.80 TSHR (0.47) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL29263767 0.79 SCN1A (0.49) ALDH1A1TSHRTDP1L3MBTL1CYP3A4

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-109553703-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-109553706-B Catalyst component for olefin polymerization, catalyst and application 中国石油化工股份有限公司 2021-04-13 CN claimed
CN-109553711-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-04-13 CN claimed
CN-109553703-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-109553706-B Catalyst component for olefin polymerization, catalyst and application 中国石油化工股份有限公司 2021-04-13 CN disclosed
CN-109553711-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-04-13 CN disclosed