SCHEMBL94678

SCHEMBL94678

CCC=CC(=O)OCC

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
SCHEMBL264771 1.00
SCHEMBL691584 1.00
Methylamine SCHEMBL11805854 0.95 HCAR2 (0.56)
SCHEMBL29260683 0.91 HCAR2 (0.69)
SCHEMBL118130 0.91 HCAR2 (0.69)
SCHEMBL17107810 0.91 HCAR2 (0.69)
SCHEMBL7792126 0.91 HCAR2 (0.69)
SCHEMBL1503638 0.91 HCAR2 (0.69)
SCHEMBL27519176 0.87 MAPT (0.61)
SCHEMBL17019599 0.85 HCAR2 (0.67)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119371609-A Curing composition, preparation method and application thereof 天合光能股份有限公司 2025-01-28 CN claimed
WO-2023087648-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND HIGH-VOLTAGE LITHIUM BATTERY CONTAINING SAME 张家港市国泰华荣化工新材料有限公司 2023-05-25 WO claimed
CN-114015299-A Preparation and application of composite nano antibacterial and antiviral coating 宿迁空天新材料有限公司 2022-02-08 CN claimed
CN-112934203-A Heavy metal removing material and method for removing heavy metal in Chinese herbal medicine extract 苏州大学 2021-06-11 CN claimed
CN-109438237-B Preparation method of 3-ethoxy ethyl acrylate 浙江华方药业股份有限公司 2021-05-28 CN claimed
CN-106188169-B A kind of synthesis of the lipid derivate containing sialic acids groups and its application in pharmaceutical preparation 沈阳药科大学 2019-06-25 CN claimed
US-20180312511-A1 SHORT-ACTING BENZODIAZEPINE DERIVATIVES, PREPARATION METHOD THEREFOR, AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2018-11-01 US claimed
EP-3363801-A1 SHORT-ACTING BENZODIAZEPINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2018-08-22 EP claimed
CN-106188169-A The synthesis of a kind of lipid derivate containing sialic acids groups and the application in pharmaceutical preparation thereof 沈阳药科大学 2016-12-07 CN claimed
CN-106133009-A Two grades of suspending agents for suspension polymerization 辛色姆(英国)有限公司 2016-11-16 CN claimed
WO-2009038232-A2 METHOD FOR PRODUCING BETA-MERCAPTOCARBOXYLIC ACIDS SHOWA DENKO K.K. (JP) 2009-03-26 WO claimed
US-7285686-B2 Process for the preparation of 1,3-substituted indenes PFIZER INC (US) 2007-10-23 US claimed
EP-1567483-A1 IMPROVED PROCESS FOR THE PREPARATION OF 1,3-SUBSTITUTED INDENES Pfizer Products Inc. (US) 2005-08-31 EP claimed
US-20050004379-A1 Process for the preparation of 1,3-substituted indenes PFIZER INC 2005-01-06 US claimed
WO-2004048318-A1 IMPROVED PROCESS FOR THE PREPARATION OF 1,3-SUBSTITUTED INDENES PFIZER PRODUCTS INC. (US) 2004-06-10 WO claimed
US-20030073834-A1 Purine compounds having PDE IV inhibitory activity and methods of synthesis CAVALLA DAVID J (GB) 2003-04-17 US claimed
EP-1045850-A4 PURINE COMPOUNDS HAVING PDE IV INHIBITORY ACTIVITY AND METHODS OF SYNTHESIS EURO CELTIQUE SA (LU) 2001-10-31 EP claimed
EP-1045850-A1 PURINE COMPOUNDS HAVING PDE IV INHIBITORY ACTIVITY AND METHODS OF SYNTHESIS Euro-Celtique S.A. (LU) 2000-10-25 EP claimed
WO-1999029694-A1 PURINE COMPOUNDS HAVING PDE IV INHIBITORY ACTIVITY AND METHODS OF SYNTHESIS EURO-CELTIQUE, S.A. (LU) 1999-06-17 WO claimed
EP-0556681-B1 Process for the preparation of esters of omega-formylalkanoic acids BASF AG (DE) 1997-05-28 EP claimed