SCHEMBL482730

SCHEMBL482730

CCC(C)OCC(C)(C)[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
SCHEMBL12013150 0.79 CYP2C19 (0.31)
SCHEMBL12013701 0.79 CYP2C19 (0.31)
SCHEMBL2495422 0.76
SCHEMBL25769245 0.75
SCHEMBL14191583 0.75 TSHR (0.32)
SCHEMBL108185 0.72 MEN1 (0.36)
SCHEMBL20762321 0.72 MEN1 (0.36)
SCHEMBL27475836 0.72 MEN1 (0.36)
SCHEMBL24772501 0.71
SCHEMBL6179314 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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117042782-A Multilayer structure using chemically crosslinked alginic acid 持田制药株式会社 2023-11-10 CN disclosed
CN-112262139-B Aminopyrrolotriazines as kinase inhibitors 百时美施贵宝公司 2023-07-25 CN disclosed
WO-2023104155-A1 LIGAND COMPOUNDS FOR E3 UBIQUITIN LIGASE, PROTEIN DEGRADERS DEVELOPED ON BASIS OF LIGAND COMPOUNDS, AND USES THEREOF 标新生物医药科技(上海)有限公司 2023-06-15 WO disclosed
US-11634444-B2 Metal organic complex, high polymer, composition, and organic electronic component GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2023-04-25 US disclosed
CN-115368393-A Triaryl-based boraopyrimidine organic compound and application thereof 哈尔滨工业大学 2022-11-22 CN disclosed
CN-115362159-A Polycyclic compound for organic electroluminescent device 默克专利有限公司 2022-11-18 CN disclosed
CN-114716908-A Front panel for display device 住友化学株式会社 2022-07-08 CN disclosed
EP-4003340-A2 ETHYNYLHETEROCYCLES AS RHO-ASSOCIATED COILED-COIL KINASE (ROCK) INHIBITORS Angion Biomedica Corp. (US) 2022-06-01 EP disclosed
US-11046791-B2 Method for producing modified conjugated diene polymer and method for producing polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-06-29 US disclosed
CN-112442031-A Pyridinopyrimidine derivatives as KRASG12C mutant protein inhibitors 南京明德新药研发有限公司 2021-03-05 CN disclosed
US-20120028995-A1 NOVEL COMPOUNDS FOR MEDICAL USE AS PEPTIDASE EFFECTORS IMTM GMBH (DE) 2012-02-02 US disclosed
EP-1772282-B1 OPTICAL RECORDING MATERIAL AND OPTICAL RECORDING MEDIUM ADEKA CORP (JP) 2012-02-01 EP disclosed
WO-2011026781-A1 NOVEL MULTIFUNCTIONAL PEPTIDASE INHIBITORS, ESPECIALLY FOR MEDICAL USE IMTM GMBH (DE) 2011-03-10 WO disclosed
EP-2292589-A1 Novel multifunctional peptidase inhibitors, especially for medical use IMTM GmbH (DE) 2011-03-09 EP disclosed
EP-2172222-A2 Novel BLT2-mediated disease, BLT2-binding agent and compound ONO PHARMACEUTICAL CO., LTD. (JP) 2010-04-07 EP disclosed
US-20080132574-A1 Novel Blt2-Mediated Disease, Blt2 Binding Agent And the Compound ONO PHARMACEUTICAL CO., LTD. (JP) 2008-06-05 US disclosed
EP-1772282-A1 OPTICAL RECORDING MATERIAL AND OPTICAL RECORDING MEDIUM Adeka Corporation (JP) 2007-04-11 EP disclosed
EP-1745800-A1 NOVEL BLT2-MEDIATED DISEASE, AND BLT2 BINDING AGENT AND COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2007-01-24 EP disclosed
US-20040053996-A1 Use of oxabicyclo[2.2.1]heptane derivatives as pesticidal agents BAYER CROPSCIENCE AG (DE) 2004-03-18 US disclosed
CN-1140172-A Cyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-01-15 CN disclosed