SCHEMBL27967151

SCHEMBL27967151

CCOC(=O)Cc1c(C(C)C)cc(C(C)C)cc1C(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 1/20 0.45
MYC P01106 1/20 0.45
SOAT1 P35610 1/20 0.45
MAP2K3 P46734 1/20 0.45
FABP3 P05413 2/20 0.44
FABP4 P15090 2/20 0.44
NLRP3 Q96P20 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
FABP5 Q01469 1/20 0.40
GAA P10253 3/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
KMT2A Q03164 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
SCHEMBL22899758 0.81 NLRP3 (0.56) SOAT2MYCSOAT1MAP2K3NLRP3
SCHEMBL8137246 0.77 FABP3 (0.57) SOAT2MYCSOAT1MAP2K3FABP3
SCHEMBL6229692 0.76 SOAT2 (0.48) SOAT2MYCSOAT1MAP2K3FABP3
SCHEMBL11888446 0.76 FABP3 (0.56) FABP3FABP4SMN1; SMN2FABP5GAA
SCHEMBL8136292 0.75 FABP4 (0.50) SOAT2MYCSOAT1MAP2K3FABP3
SCHEMBL7207662 0.74 FABP4 (0.58) SOAT2MYCSOAT1MAP2K3FABP3
SCHEMBL7349278 0.73 ALDH1A1 (0.44) FABP3FABP4NLRP3SMN1; SMN2GAA
SCHEMBL18050780 0.73 BCHE (0.37) SOAT2MYCSOAT1MAP2K3FABP3
SCHEMBL25664507 0.73 GAA (0.57) SMN1; SMN2GAAKDM4EALDH1A1LMNA
SCHEMBL20759997 0.72 MAPT (0.52) SMN1; SMN2KDM4EALDH1A1LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112778442-A Olefin polymerization catalyst solid component, preparation method thereof, olefin polymerization catalyst and application 中国石油化工股份有限公司 2021-05-11 CN claimed
CN-112759683-A Olefin polymerization catalyst and application 中国石油化工股份有限公司 2021-05-07 CN claimed
CN-116135892-B Method for preparing bimodal polyethylene resin for pipe material and bimodal polyethylene resin thereof 中国石油化工股份有限公司 2024-10-15 CN disclosed
CN-111057168-B Catalyst for olefin polymerization and preparation method and application thereof 中国石油化工股份有限公司 2022-07-12 CN disclosed
CN-112778442-A Olefin polymerization catalyst solid component, preparation method thereof, olefin polymerization catalyst and application 中国石油化工股份有限公司 2021-05-11 CN disclosed
CN-112759683-A Olefin polymerization catalyst and application 中国石油化工股份有限公司 2021-05-07 CN disclosed
CN-111057168-A Catalyst for olefin polymerization and preparation method and application thereof 中国石油化工股份有限公司 2020-04-24 CN disclosed
CN-103772536-A Catalyst component for polymerization or copolymerization of ethylene and catalyst thereof CHINA PETROLEUM & CHEMICAL 2014-05-07 CN disclosed