SCHEMBL436673

SCHEMBL436673

O=C1COC2C(=O)COC12

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
SCHEMBL10016805 1.00
SCHEMBL10016812 0.84
SCHEMBL13505444 0.78
SCHEMBL20323144 0.71
SCHEMBL11757396 0.68
SCHEMBL24621340 0.67
SCHEMBL10016807 0.67
SCHEMBL12753015 0.67
SCHEMBL10048336 0.67 THRB (0.44)
SCHEMBL1735065 0.67 THRB (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130116451-A1 METHOD FOR PREPARING DIAMINO-DIANHYDRO-DIDEOXYHEXITOLS, PARTICULARLY PREFERABLY 2,5-DIAMINO-1,4:3,6-DIANHYDRO-2,5-DIDEOXY-D-HEXITOL EVONIK DEGUSSA GMBH (DE) 2013-05-09 US claimed
EP-2393768-B1 METHOD FOR PRODUCING ALDEHYDES AND KETONES FROM PRIMARY AND SECONDARY ALCOHOLS EVONIK DEGUSSA GMBH (DE) 2015-05-13 EP disclosed
US-9029412-B2 Method for preparing diamino-dianhydro-dideoxyhexitols, particularly preferably 2,5-diamino-1,4:3,6-dianhydro-2,5-dideoxy-D-hexitol EVONIK DEGUSSA GMBH (DE) 2015-05-12 US disclosed
US-9029412-B2 Method for preparing diamino-dianhydro-dideoxyhexitols, particularly preferably 2,5-diamino-1,4:3,6-dianhydro-2,5-dideoxy-D-hexitol EVONIK DEGUSSA GMBH (DE) 2015-05-12 US disclosed
US-9029412-B2 Method for preparing diamino-dianhydro-dideoxyhexitols, particularly preferably 2,5-diamino-1,4:3,6-dianhydro-2,5-dideoxy-D-hexitol EVONIK DEGUSSA GMBH (DE) 2015-05-12 US disclosed
EP-2697231-B1 CONTINUOUSLY USABLE METHOD FOR MANUFACTURING CARBONYL COMPOUNDS USING A NITROXYL RADICAL BASED CATALYST EVONIK DEGUSSA GMBH (DE) 2015-02-18 EP disclosed
CN-102307880-B Method for producing 2,6-dioxabicyclo-(3,3,0)-octane-4,8-dione EVONIK DEGUSSA GMBH 2014-11-26 CN disclosed
US-8841096-B2 Method for producing multicyclical ring systems carrying amino groups EVONIK DEGUSSA GMBH (DE) 2014-09-23 US disclosed
US-8841096-B2 Method for producing multicyclical ring systems carrying amino groups EVONIK DEGUSSA GMBH (DE) 2014-09-23 US disclosed
EP-2393931-B1 PROCESS FOR THE AMINATION OF MULTICYCLIC KETONES EMPLOYING TRANSAMINASES EVONIK DEGUSSA GMBH (DE) 2014-03-12 EP disclosed
EP-2393768-A1 METHOD FOR PRODUCING ALDEHYDES AND KETONES FROM PRIMARY AND SECONDARY ALCOHOLS Evonik Degussa GmbH (DE) 2011-12-14 EP disclosed
EP-2393817-A1 METHOD FOR PRODUCING 2,6-DIOXABICYCLO-(3.3.0)-OCTANE-4,8-DIONE Evonik Degussa GmbH (DE) 2011-12-14 EP disclosed
US-20110269977-A1 METHOD FOR PRODUCING 2,6-DIOXABICYCLO-(3.3.0)-OCTANE-4,8-DIONE EVONIK DEGUSSA GMBH (DE) 2011-11-03 US disclosed
US-20110269977-A1 METHOD FOR PRODUCING 2,6-DIOXABICYCLO-(3.3.0)-OCTANE-4,8-DIONE EVONIK DEGUSSA GMBH (DE) 2011-11-03 US disclosed
US-20110251399-A1 METHOD FOR PRODUCING ALDEHYDES AND KETONES FROM PRIMARY AND SECONDARY ALCOHOLS EVONIK DEGUSSA GMBH (DE) 2011-10-13 US disclosed
WO-2010089223-A1 METHOD FOR PRODUCING 2,6-DIOXABICYCLO-(3.3.0)-OCTANE-4,8-DIONE EVONIK DEGUSSA GMBH (DE) 2010-08-12 WO disclosed
WO-2010089223-A1 METHOD FOR PRODUCING 2,6-DIOXABICYCLO-(3.3.0)-OCTANE-4,8-DIONE EVONIK DEGUSSA GMBH (DE) 2010-08-12 WO disclosed
WO-2010089213-A1 METHOD FOR PRODUCING ALDEHYDES AND KETONES FROM PRIMARY AND SECONDARY ALCOHOLS EVONIK DEGUSSA GMBH (DE) 2010-08-12 WO disclosed
WO-2010089171-A2 METHOD FOR PRODUCING MULTICYCLICAL RING SYSTEMS CARRYING AMINO GROUPS EVONIK DEGUSSA GMBH (DE) 2010-08-12 WO disclosed
EP-0230557-A2 2,6-Dioxabicyclo[3.3.0]octane derivatives, their preparation and use as medicament Heinrich Mack Nachf. (DE) 1987-08-05 EP disclosed