SCHEMBL28123232

SCHEMBL28123232

CCCC(CC(C)C)(C(=O)O)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.34
GRM3 Q14832 1/20 0.34
MMP8 P22894 1/20 0.32
CHRM1 P11229 1/20 0.31
AKR1A1 P14550 1/20 0.31
CHRM3 P20309 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
DRD3 P35462 1/20 0.31
SLC6A3 Q01959 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL6158271 0.87 AKR1B1 (0.33) GRM2GRM3
SCHEMBL28181566 0.83 LMNA (0.33) MMP8
SCHEMBL28222033 0.83 MMP8 (0.46) MMP8CYP2C19
SCHEMBL2139826 0.83 GRM2 (0.39) GRM2GRM3TDP1CYP2D6CYP2C19
SCHEMBL28310522 0.82 MMP8 (0.35) MMP8CYP2D6CYP2C19
SCHEMBL3896850 0.81 GRM2 (0.36) GRM2GRM3MMP8TDP1CYP2D6
SCHEMBL1031267 0.80 FFAR3 (0.38) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL7624691 0.79 GRM2 (0.35) GRM2GRM3MMP8CYP2D6CYP2C19
SCHEMBL2323212 0.78 FFAR3 (0.37) GRM2GRM3MMP8HDAC1HDAC2
SCHEMBL27814491 0.78 ACE2 (0.31) GRM2GRM3

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-110452238-A Pyrimidine compound and application thereof DONGGUAN DONGYANGGUANG PESTICIDE RES AND DEVELOPMENT CO LTD 2019-11-15 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-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-105837714-B The manufacturing method of solid catalyst component for olefin polymerization, the manufacturing method of polymerization of olefines catalyst and olefin polymer 东邦钛株式会社 2018-07-20 CN disclosed
CN-104513328-B Carbon monoxide-olefin polymeric and its application for olefinic polyreaction 中国石油化工股份有限公司 2017-09-29 CN disclosed
CN-104640887-B The manufacture method of manufacture method for the ingredient of solid catalyst of olefin polymerization, the catalyst for olefin polymerization and olefin polymerization 东邦钛株式会社 2017-08-29 CN disclosed
CN-104513331-B Carbon monoxide-olefin polymeric and its application for olefinic polymerization 中国石油化工股份有限公司 2017-06-06 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-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 disclosed
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 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