SCHEMBL1414481

SCHEMBL1414481

C=CCC(N)(O)C(N)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
SCHEMBL4787295 0.75
SCHEMBL11237698 0.69
SCHEMBL6280867 0.69
SCHEMBL5421494 0.67
Hydrochloric Acid SCHEMBL23581920 0.67
SCHEMBL974133 0.65
SCHEMBL7038085 0.65
SCHEMBL2510404 0.65
SCHEMBL11806034 0.65
SCHEMBL6688795 0.65

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102046629-A Method for producing hydroxyalkyltriethylenediamine compound and catalyst composition for producing polyurethane resin using the same TOSOH CORP 2011-05-04 CN claimed
US-20110077376-A1 PROCESS FOR PRODUCING HYDROXYALKYLTRIETHYLENEDIAMINE, AND CATALYST COMPOSITION FOR THE PRODUCTION OF POLYURETHANE RESIN USING IT TOSOH CORPORATION (JP) 2011-03-31 US claimed
EP-2295438-A1 PROCESS FOR PRODUCING HYDROXYALKYLTRIETHYLENEDIAMINE COMPOUND, AND CATALYST COMPOSITION FOR THE PRODUCTION OF POLYURETHANE RESIN USING THE HYDROXYALKYLTRIETHYLENEDIAMINE COMPOUND Tosoh Corporation (JP) 2011-03-16 EP claimed
EP-2295438-B1 PROCESS FOR PRODUCING HYDROXYALKYLTRIETHYLENEDIAMINE COMPOUND, AND CATALYST COMPOSITION FOR THE PRODUCTION OF POLYURETHANE RESIN USING THE HYDROXYALKYLTRIETHYLENEDIAMINE COMPOUND TOSOH CORP (JP) 2015-03-18 EP disclosed
CN-103265677-A Process for producing hydroxyalkyltriethylenediamine compound, and catalyst composition for the production of polyurethane resin using the hydroxyalkyltriethylenediamine compound TOSOH CORP 2013-08-28 CN disclosed
CN-102046629-A Method for producing hydroxyalkyltriethylenediamine compound and catalyst composition for producing polyurethane resin using the same TOSOH CORP 2011-05-04 CN disclosed
US-20110077376-A1 PROCESS FOR PRODUCING HYDROXYALKYLTRIETHYLENEDIAMINE, AND CATALYST COMPOSITION FOR THE PRODUCTION OF POLYURETHANE RESIN USING IT TOSOH CORPORATION (JP) 2011-03-31 US disclosed
EP-2295438-A1 PROCESS FOR PRODUCING HYDROXYALKYLTRIETHYLENEDIAMINE COMPOUND, AND CATALYST COMPOSITION FOR THE PRODUCTION OF POLYURETHANE RESIN USING THE HYDROXYALKYLTRIETHYLENEDIAMINE COMPOUND Tosoh Corporation (JP) 2011-03-16 EP disclosed
JP-2011042587-A METHOD FOR PRODUCING HYDROXY(ALKYL)PIPERAZINES TOSOH CORP 2011-03-03 JP disclosed
JP-2010120887-A MANUFACTURING METHOD OF HYDROXYALKYLPIPERAZINES TOSOH CORP 2010-06-03 JP disclosed