SCHEMBL1436764

SCHEMBL1436764

[CH2]C(C)(CO)CO

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
SCHEMBL5275160 0.82
SCHEMBL17241891 0.79
SCHEMBL93438 0.78
SCHEMBL3033018 0.78
SCHEMBL8439516 0.77
SCHEMBL271773 0.75
SCHEMBL2806747 0.75
SCHEMBL28299907 0.75 TSHR (0.33)
SCHEMBL15546776 0.75
SCHEMBL9171761 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 230 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3921075-B1 CLEAVABLE MULTI-ALCOHOL-BASED MICROCAPSULES FIRMENICH & CIE (CH) 2024-06-12 EP claimed
WO-2023230217-A1 ANTILEISHMANIAL COMPOUNDS, COMPOSITIONS AND USE THEREOF TRUSTEES OF BOSTON UNIVERSITY (US) 2023-11-30 WO claimed
US-20230381142-A1 ANTILEISHMANIAL COMPOUNDS, COMPOSITIONS AND USE THEREOF TRUSTEES OF BOSTON UNIVERSITY (US) 2023-11-30 US claimed
US-20230250369-A9 CLEAVEABLE MULTI-ALCOHOL-BASED MICROCAPSULES FIRMENICH SA (CH) 2023-08-10 US claimed
US-20230167342-A1 POLYOL COMPOUNDS AND ADHESIVE COMPOSITIONS PREPARED WITH THE SAME ARKEMA FRANCE (FR) 2023-06-01 US claimed
US-20220169954-A1 CLEAVEABLE MULTI-ALCOHOL-BASED MICROCAPSULES FIRMENICH & CIE (CH) 2022-06-02 US claimed
EP-3921075-A1 CLEAVABLE MULTI-ALCOHOL-BASED MICROCAPSULES Firmenich SA (CH) 2021-12-15 EP claimed
CN-113573804-A Cleavable polyol-based microcapsules 弗门尼舍有限公司 2021-10-29 CN claimed
WO-2021023645-A1 CLEAVABLE MULTI-ALCOHOL-BASED MICROCAPSULES FIRMENICH SA (CH) 2021-02-11 WO claimed
EP-1097928-B1 5-(2,3-Dialkoxyphenyl)-4,1-benzoxazepin-2-ones as anti-hyperlipidemics TAKEDA PHARMACEUTICAL (JP) 2008-07-16 EP claimed
US-20070015792-A1 N-dihydroxyalkyl-substituted 2-oxo-imidazole derivatives MSD K.K. (JP) 2007-01-18 US claimed
US-20040072819-A1 Benzoxazepine compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. 2004-04-15 US claimed
US-6613761-B1 (3R,5S)-N- methanesulfonyl-7-chloro-5-(2,3-dimethoxyphenyl) -1-(3-hydroxy-2,2-dimethylpropyl)-2-oxo-1,2,3,5-tetrahydro-4, 1-benzoxazepine-3-acetamide, used as antilipemic agents and enzyme inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-09-02 US claimed
CN-1072649-C Benzoxazepine compounds, their production method and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-10-10 CN claimed
EP-1097928-A1 5-(2,3-Dialkoxyphenyl)-4,1-benzoxazepin-2-ones as anti-hyperlipidemics Takeda Chemical Industries, Ltd. (JP) 2001-05-09 EP claimed
US-5965553-A Squalene synthetase inhibitors PFIZER INC. (US) 1999-10-12 US claimed
CN-1196052-A Benzoxazepine compounds, process for producing the same and use thereof TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-10-14 CN claimed
EP-0862562-A1 BENZOXAZEPINE COMPOUNDS, THEIR PRODUCTION AND USE AS LIPID LOWERING AGENTS Takeda Chemical Industries, Ltd. (JP) 1998-09-09 EP claimed
EP-0814080-A1 Squalene synthetase inhibitors PFIZER INC. (US) 1997-12-29 EP claimed
WO-1997010224-A1 BENZOXAZEPINE COMPOUNDS, THEIR PRODUCTION AND USE AS LIPID LOWERING AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-03-20 WO claimed