SCHEMBL920173

SCHEMBL920173

C[C](C)CC=O

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
SCHEMBL14240697 0.77 ALDH1A1 (0.38)
SCHEMBL60367 0.74
Phosphoric Acid SCHEMBL27520956 0.72 ALDH1A1 (0.33)
SCHEMBL19664757 0.72
SCHEMBL10771605 0.72
SCHEMBL23530995 0.72
SCHEMBL14602490 0.72
SCHEMBL25238619 0.72
SCHEMBL10446072 0.72
SCHEMBL23094106 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107365975-A Delivery container with flow distributor 弗萨姆材料美国有限责任公司 2017-11-21 CN claimed
CN-106148914-A For the container of precursor in depositing operation 气体产品与化学公司 2016-11-23 CN claimed
CN-105518826-A Surface treatment for CCTBA-based CVD cobalt nucleation on dielectric substrates APPLIED MATERIALS INC 2016-04-20 CN claimed
CN-116669737-A Antagonists of muscarinic acetylcholine receptor M4 范德堡大学 2023-08-29 CN disclosed
WO-2021143511-A1 N, O TYPE MULTIDENTATE FUNCTIONAL MONOMER, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF IN ION IMPRINTING MATERIAL 武汉赛沣瑞技术有限公司 2021-07-22 WO disclosed
CN-107889486-B Pyridin-2-ylpyridin/compounds and methods of use thereof 日本曹达株式会社 2021-07-09 CN disclosed
US-10654818-B2 Furane derivatives as inhibitors of ATAD2 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-05-19 US disclosed
CN-107827956-B Synthesis method of active cyclic octapeptide reniohalistatin E and analogues thereof 暨南大学 2020-05-08 CN disclosed
CN-107827956-B Synthesis method of active cyclic octapeptide reniohalistatin E and analogues thereof 暨南大学 2020-05-08 CN disclosed
US-10618882-B2 Pyridine-2-yl pyridinium compound and method of using same NIPPON SODA CO., LTD. (JP) 2020-04-14 US disclosed
EP-3383865-B1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 Bayer Pharma AG (DE) 2020-01-29 EP disclosed
EP-1515724-A1 MITOTIC KINESIN INHIBITORS Merck & Co., Inc. (US) 2005-03-23 EP disclosed
WO-2004111193-A2 PRODRUGS OF MITOTIC KINESIN INHIBITORS MERCK & CO., INC. (US) 2004-12-23 WO disclosed
WO-2004087050-A2 MITOTIC KINESIN INHIBITORS MERCK & CO., INC. (US) 2004-10-14 WO disclosed
US-20040152724-A1 Azabicyclic compounds are central nervous system active agents ABBVIE INC. 2004-08-05 US disclosed
US-20040044029-A1 Azabicyclic compounds are central nervous system active agents ABBOTT LABORATORIES 2004-03-04 US disclosed
WO-2004016604-A2 AZABICYCLIC COMPOUNDS ARE CENTRAL NERVOUS SYSTEM ACTIVE AGENTS ABBOTT LABORATORIES (US) 2004-02-26 WO disclosed
WO-2003105855-A1 MITOTIC KINESIN INHIBITORS MERCK & CO., INC. (US) 2003-12-24 WO disclosed
WO-2003106417-A1 MITOTIC KINESIN INHIBITORS MERCK & CO., INC. (US) 2003-12-24 WO disclosed
CN-1114714-A Reducing exhaust emissions from otto-cycle engines ETHYL CORP (US) 1996-01-10 CN disclosed