SCHEMBL2864748

SCHEMBL2864748

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

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL21313355 0.83
SCHEMBL21313373 0.79
SCHEMBL27966184 0.71 ALDH1A1 (0.30)
SCHEMBL21313359 0.69 LMNA (0.30)
SCHEMBL9750707 0.65 TSHR (0.33)
SCHEMBL21313352 0.61
SCHEMBL14993364 0.61
SCHEMBL3245939 0.60 ALDH1A1 (0.40)
SCHEMBL4818426 0.60 TSHR (0.43)
SCHEMBL16286962 0.60 TSHR (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3533776-B1 MAGNESIUM ALKOXIDE PARTICLE AND APPLICATION THEREOF CHINA PETROLEUM & CHEM CORP (CN) 2023-09-27 EP 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 claimed
US-11332425-B2 Magnesium alkoxide particle and application thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2022-05-17 US 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
US-20190270690-A1 MAGNESIUM ALKOXIDE PARTICLE AND APPLICATION THEREOF CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2019-09-05 US claimed
EP-3533776-A1 MAGNESIUM ALKOXIDE PARTICLE AND APPLICATION THEREOF China Petroleum&Chemical Corporation (CN) 2019-09-04 EP claimed
EP-3533776-B1 MAGNESIUM ALKOXIDE PARTICLE AND APPLICATION THEREOF CHINA PETROLEUM & CHEM CORP (CN) 2023-09-27 EP disclosed
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
US-11332425-B2 Magnesium alkoxide particle and application thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2022-05-17 US 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-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-110511301-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2020-10-20 CN disclosed
US-20190270690-A1 MAGNESIUM ALKOXIDE PARTICLE AND APPLICATION THEREOF CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2019-09-05 US disclosed
EP-3533776-A1 MAGNESIUM ALKOXIDE PARTICLE AND APPLICATION THEREOF China Petroleum&Chemical Corporation (CN) 2019-09-04 EP disclosed
US-7750162-B2 Process for preparation of nonnatural amino acid and intermediate thereof DAISO CO., LTD. (JP) 2010-07-06 US disclosed
US-20070208180-A1 Process for Preparation of Nonnatural Amino Acid and Intermediate Thereof DAISO CO., LTD. (JP) 2007-09-06 US disclosed
EP-1739077-A1 PROCESS FOR PRODUCTION OF NONNATURAL AMINO ACIDS AND INTERMEDIATES THEREFOR DAISO CO., LTD. (JP) 2007-01-03 EP disclosed