SCHEMBL9750707

SCHEMBL9750707

CCC(C)(OC(C)(CC)C(C)C)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
ALDH1A1 P00352 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
SCHEMBL8289823 0.79
SCHEMBL23883550 0.77
SCHEMBL21847373 0.77 TSHR (0.31) TSHRTDP1
SCHEMBL28181221 0.77 TSHR (0.30) TSHRTDP1
SCHEMBL11409604 0.77
SCHEMBL5013725 0.73 TSHR (0.33) TSHR
SCHEMBL14990863 0.73 TSHR (0.33) TSHRALDH1A1
SCHEMBL28181963 0.73
SCHEMBL277029 0.71 TDP1 (0.42) TDP1
SCHEMBL6325666 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112661882-B Application of cyclohexene-1,2-dicarboxylic acid ester compound 中国石油化工股份有限公司 2022-10-21 CN claimed
CN-112661882-A Application of cyclohexene-1, 2-dicarboxylate compound 中国石油化工股份有限公司 2021-04-16 CN claimed
CN-107344973-B Catalyst component for olefin polymerization, catalyst system and application thereof 中国石油化工股份有限公司 2021-03-16 CN claimed
CN-107344976-B Catalyst component for olefin polymerization, catalyst system and application thereof 中国石油化工股份有限公司 2021-03-16 CN claimed
CN-112661882-B Application of cyclohexene-1,2-dicarboxylic acid ester compound 中国石油化工股份有限公司 2022-10-21 CN disclosed
CN-112661882-A Application of cyclohexene-1, 2-dicarboxylate compound 中国石油化工股份有限公司 2021-04-16 CN disclosed
CN-107344976-B Catalyst component for olefin polymerization, catalyst system and application thereof 中国石油化工股份有限公司 2021-03-16 CN disclosed
CN-107344973-B Catalyst component for olefin polymerization, catalyst system and application thereof 中国石油化工股份有限公司 2021-03-16 CN disclosed
CN-109111536-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-03-16 CN disclosed
CN-109111539-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-02-05 CN disclosed
EP-0284005-B1 METHOD OF PRODUCTION OF POLYOLEFINS IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1991-12-18 EP disclosed
US-4981930-A POLYMERIZATION CATALYSTS IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) 1991-01-01 US disclosed
EP-0284005-A2 Method of production of polyolefins IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1988-09-28 EP disclosed
US-4748283-A POLYMERIZATION CATALYSTS LITHIUM CORPORATION OF AMERICA (US) 1988-05-31 US disclosed