SCHEMBL408600

SCHEMBL408600

O=C(Cl)OCC=CCl

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
SCHEMBL5548982 0.86 ALDH1A1 (0.36)
SCHEMBL5548980 0.86 ALDH1A1 (0.36)
SCHEMBL10912039 0.80
SCHEMBL4445301 0.79
SCHEMBL9603875 0.79
SCHEMBL27755489 0.78
SCHEMBL17598252 0.77
SCHEMBL8504067 0.77
SCHEMBL400163 0.77
SCHEMBL308302 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3214066-B1 PROCESS FOR THE PREPARATION OF FLUOROALKYL FLUOROFORMATES SOLVAY FLUOR GMBH (DE) 2024-02-21 EP claimed
EP-3214066-A2 PROCESS FOR THE PREPARATION OF FLUOROALKYL FLUOROFORMATES Solvay Fluor GmbH (DE) 2017-09-06 EP claimed
WO-2013026777-A1 FLUOROALKYL S-(FLUORO)ALKYL THIOCARBONATES, A METHOD FOR THE PREPARATION OF FLUOROALKYL S-(FLUORO)ALKYL THIOCARBONATES, AND THEIR USE SOLVAY SA (BE) 2013-02-28 WO claimed
EP-2454226-A1 PROCESS FOR THE PREPARATION OF FLUOROALKYL (FLUORO)ALKYL CARBONATES AND CARBAMATES Solvay Fluor GmbH (DE) 2012-05-23 EP claimed
US-20120116111-A1 Process for the preparation of fluoroalkyl (fluoro)alkyl carbonates and carbamates SOLVAY FLUOR GMBH (DE) 2012-05-10 US claimed
WO-2011006822-A1 PROCESS FOR THE PREPARATION OF FLUOROALKYL (FLUORO)ALKYL CARBONATES AND CARBAMATES SOLVAY FLUOR GMBH (DE) 2011-01-20 WO claimed
EP-1730132-A2 PROCESS FOR PREPARING PHARMACEUTICALLY ACCEPTABLE SALTS OF DULOXETINE AND INTERMEDIATES THEREOF Teva Pharmaceutical Industries Ltd (IL) 2006-12-13 EP claimed
US-20060194869-A1 Process for preparing pharmaceutically acceptable salts of duloxetine and intermediates thereof TEVA PHARMACEUTICAL INDUSTRIES LTD (IL) 2006-08-31 US claimed
WO-2006071868-A2 PROCESS FOR PREPARING PHARMACEUTICALLY ACCEPTABLE SALTS OF DULOXETINE AND INTERMEDIATES THEREOF TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2006-07-06 WO claimed
US-5091581-A Reacting diaminonitrobenzene with chloroalkyl chloroformate HANS SCHWARZKOPF GMBH (DE) 1992-02-25 US claimed
JP-3017045-A None JP disclosed
JP-7149696-A None JP disclosed
CN-114728883-B Ibuprofen ester prodrug, pharmaceutical composition, preparation method and application 南京海融医药科技股份有限公司 2024-07-12 CN disclosed
US-20240207411-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS SEAPORT THERAPEUTICS, INC. 2024-06-27 US disclosed
CN-118063537-A Prodrugs of directed lymphatics 莫纳什大学 2024-05-24 CN disclosed
JP-H07149696-A PREPARATION OF HYDROXYALKYLAMINONITROBENZENE DERIVATIVE CASSELLA AG 1995-06-13 JP disclosed
US-5414128-A Dehydrofluorination for amination CASSELLA AG (DE) 1995-05-09 US disclosed
US-5091581-A Reacting diaminonitrobenzene with chloroalkyl chloroformate HANS SCHWARZKOPF GMBH (DE) 1992-02-25 US disclosed
US-5091581-A Reacting diaminonitrobenzene with chloroalkyl chloroformate HANS SCHWARZKOPF GMBH (DE) 1992-02-25 US disclosed
JP-H0317045-A SELECTIVE PREPARATION OF N4-SUBSTITUTED 1,4-DIAMINO-2-NIROBENZENE AND N4-SUBSTITUTED 1,4-DIAMINO-2-NITROBENZENE HANS SCHWARZKOPF GMBH 1991-01-25 JP disclosed