SCHEMBL28123779

SCHEMBL28123779

CCCC(C(=O)OCc1ccccc1)C(=O)OCc1ccccc1.O=C(/C=C\C(=O)OC1CCCCC1)OC1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.43
CYP3A4 P08684 2/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
CACNA1B Q00975 2/20 0.39
ALDH1A1 P00352 2/20 0.39
FKBP1A P62942 1/20 0.39
CHRM2 P08172 2/20 0.39
CHRM4 P08173 2/20 0.39
CHRM5 P08912 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.39
LMNA P02545 1/20 0.39
EPHX1 P07099 1/20 0.38
CYP2D6 P10635 2/20 0.38
CYP1A2 P05177 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 1/20 0.37

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
SCHEMBL28123186 0.94 CACNA1B (0.39) HCAR2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL28817697 0.86 CTSB (0.48) HCAR2CYP3A4CYP2C9CYP2C19CACNA1B
SCHEMBL28004332 0.81 CHRM2 (0.35) CYP3A4ALDH1A1CHRM2CHRM4CHRM5
SCHEMBL28003838 0.81 HCAR2 (0.49) HCAR2L3MBTL1CACNA1BALDH1A1FKBP1A
SCHEMBL28003874 0.81 TP53 (0.44) HCAR2L3MBTL1CACNA1BALDH1A1LMNA
SCHEMBL28003834 0.80 NAAA (0.43) CYP2C19L3MBTL1ALDH1A1CHRM2CHRM4
SCHEMBL19105243 0.80 ALDH1A1 (0.56) HCAR2CYP3A4L3MBTL1ALDH1A1LMNA
SCHEMBL28004315 0.79 HCAR2 (0.45) HCAR2L3MBTL1CACNA1BALDH1A1FKBP1A
SCHEMBL28126628 0.79 EPHX1 (0.43) CYP2C19L3MBTL1CACNA1BALDH1A1CHRM2
SCHEMBL28004289 0.78 ALDH1A1 (0.43) HCAR2CYP3A4L3MBTL1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106608939-B The preparation method of catalytic component for olefinic polymerization 中国石油化工股份有限公司 2019-08-20 CN claimed
CN-106608940-B The preparation method of catalytic component for olefinic polymerization 中国石油化工股份有限公司 2019-06-28 CN claimed
CN-104558290-B One kind being used for catalyst component for olefin polymerization and catalyst 中国石油化工股份有限公司 2018-11-02 CN claimed
CN-104558291-B One kind is used for olefin polymerization catalysis preparation method 中国石油化工股份有限公司 2017-05-31 CN claimed
CN-104558292-B One kind is used for olefin polymerization catalysis preparation method 中国石油化工股份有限公司 2017-05-31 CN claimed
CN-106608939-A Preparation method of catalyst component for olefin polymerization 中国石油化工股份有限公司 2017-05-03 CN claimed
CN-106608940-A Preparation method for catalyst components used for olefin polymerization 中国石油化工股份有限公司 2017-05-03 CN claimed
CN-104558293-B Catalyst component for olefin polymerization and catalyst 中国石油化工股份有限公司 2017-02-15 CN claimed
CN-106608939-B The preparation method of catalytic component for olefinic polymerization 中国石油化工股份有限公司 2019-08-20 CN disclosed
CN-106608940-B The preparation method of catalytic component for olefinic polymerization 中国石油化工股份有限公司 2019-06-28 CN disclosed
CN-109679006-A Catalytic component and catalyst system and Prepolymerized catalyst system and olefine polymerizing process for olefinic polymerization 中国石油化工股份有限公司 2019-04-26 CN disclosed
CN-109679004-A Catalytic component and catalyst system and Prepolymerized catalyst system and olefine polymerizing process for olefinic polymerization 中国石油化工股份有限公司 2019-04-26 CN disclosed
CN-109678997-A Catalytic component and catalyst and pre-polymerized catalyst and olefine polymerizing process for olefinic polymerization 中国石油化工股份有限公司 2019-04-26 CN disclosed
CN-109678996-A Catalytic component and catalyst system and Prepolymerized catalyst system and olefine polymerizing process for olefinic polymerization 中国石油化工股份有限公司 2019-04-26 CN disclosed
CN-109678998-A Catalytic component and catalyst system and Prepolymerized catalyst system and olefine polymerizing process for olefinic polymerization 中国石油化工股份有限公司 2019-04-26 CN disclosed
CN-104558290-B One kind being used for catalyst component for olefin polymerization and catalyst 中国石油化工股份有限公司 2018-11-02 CN disclosed
CN-104558291-B One kind is used for olefin polymerization catalysis preparation method 中国石油化工股份有限公司 2017-05-31 CN disclosed
CN-104558292-B One kind is used for olefin polymerization catalysis preparation method 中国石油化工股份有限公司 2017-05-31 CN disclosed
CN-104558293-B Catalyst component for olefin polymerization and catalyst 中国石油化工股份有限公司 2017-02-15 CN disclosed