SCHEMBL28565898

SCHEMBL28565898

C=CCOC(=O)C(CCCC)(CCCC)C(=O)OCCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.47
HPGD P15428 1/20 0.47
ATM Q13315 1/20 0.42
ALDH1A1 P00352 1/20 0.40
HCAR2 Q8TDS4 3/20 0.38
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 2/20 0.33
NAAA Q02083 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HSD17B10 Q99714 1/20 0.33
APP P05067 1/20 0.32
LMNA P02545 1/20 0.32
ESR1 P03372 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL28558109 0.97 TSHR (0.47) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL28560106 0.94 TSHR (0.47) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL28647759 0.94 TSHR (0.47) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL28562830 0.94 TSHR (0.46) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL28123171 0.93 TSHR (0.51) TSHRHPGDATMALDH1A1MAPT
SCHEMBL28549680 0.92 TSHR (0.49) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL28653702 0.89 TSHR (0.49) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL28549305 0.89 TSHR (0.49) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL28649619 0.89 TSHR (0.49) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL28554033 0.88 TSHR (0.54) TSHRHPGDATMMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109678996-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-11-19 CN disclosed
CN-109678998-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-11-19 CN disclosed
CN-109678997-B Catalyst component and catalyst for olefin polymerization, prepolymerized catalyst and olefin polymerization method 中国石油化工股份有限公司 2021-11-19 CN disclosed
CN-109679006-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-08-03 CN disclosed
CN-109679004-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-05-11 CN disclosed