SCHEMBL207064

SCHEMBL207064

COCC(C)(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
SCHEMBL1515439 0.78
SCHEMBL13925137 0.77 TDP1 (0.30)
SCHEMBL10648174 0.76
SCHEMBL2844606 0.74
SCHEMBL9630407 0.73 MEN1 (0.30)
SCHEMBL3369709 0.73
SCHEMBL2925467 0.72
SCHEMBL21517630 0.72
SCHEMBL28110159 0.71
SCHEMBL12451953 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 159 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3261639-B1 SUBSTITUTED PYRAZOLE COMPOUNDS AS SERINE PROTEASE INHIBITORS VERSEON INT CORPORATION (US) 2022-08-24 EP claimed
EP-2651875-B1 AMINES HAVING SECONDARY ALIPHATIC AMINO GROUPS SIKA TECH AG (CH) 2017-08-30 EP claimed
US-9556160-B2 Guanidine compound ASTELLAS PHARMA INC. (JP) 2017-01-31 US claimed
EP-2695881-B1 GUANIDINE COMPOUND ASTELLAS PHARMA INC (JP) 2016-04-27 EP claimed
US-9290603-B2 Amines having secondary aliphatic amino groups SIKA TECHNOLOGY AG (CH) 2016-03-22 US claimed
US-20150203480-A1 GUANIDINE COMPOUND ASTELLAS PHARMA INC. (JP) 2015-07-23 US claimed
US-8927438-B2 Methods for manufacturing high dielectric constant films APPLIED MATERIALS, INC. (US) 2015-01-06 US claimed
EP-2695881-A1 GUANIDINE COMPOUND Astellas Pharma Inc. (JP) 2014-02-12 EP claimed
EP-2651875-A1 AMINES HAVING SECONDARY ALIPHATIC AMINO GROUPS Sika Technology AG (CH) 2013-10-23 EP claimed
US-20130237681-A1 AMINES HAVING SECONDARY ALIPHATIC AMINO GROUPS SIKA TECHNOLOGY AG (CH) 2013-09-12 US claimed
US-20120270409-A1 Methods For Manufacturing High Dielectric Constant Films APPLIED MATERIALS, INC. (US) 2012-10-25 US claimed
WO-2012080264-A1 AMINES HAVING SECONDARY ALIPHATIC AMINO GROUPS SIKA TECHNOLOGY AG (CH) 2012-06-21 WO claimed
EP-2465842-A1 Amines with secondary aliphatic amines Sika Technology AG (CH) 2012-06-20 EP claimed
EP-1165538-B1 PROCESS FOR THE PREPARATION OF ALPHA-METHYLENELACTONES AND ALPHA-SUBSTITUTED HYDROCARBYLIDENE LACTONES DU PONT (US) 2004-11-17 EP claimed
US-6531616-B2 Contacting lactone compound with an oxalate in presence of a base and a solvent to form an intermediate mixture; reacting with a formaldehyde derivative to form a product mixture; isolating alpha - substituted hydrocarbylidene lactones E. I. DU PONT DE NEMOURS AND COMPANY 2003-03-11 US claimed
JP-2002540201-A 2002-11-26 JP claimed
US-20020143195-A1 Process for the preparation of a-methylenelactones and a-substituted hydrocarbylidene lactones E. I. DU PONT DE NEMOURS AND COMPANY 2002-10-03 US claimed
EP-1165538-A2 PROCESS FOR THE PREPARATION OF ALPHA-METHYLENELACTONES AND ALPHA-SUBSTITUTED HYDROCARBYLIDENE LACTONES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2002-01-02 EP claimed
US-6232474-B1 HEATING E. I. DU PONT DE NEMOURS AND COMPANY 2001-05-15 US claimed
WO-2000058298-A2 PROCESS FOR THE PREPARATION OF α-METHYLENELACTONES AND α-SUBSTITUTED HYDROCARBYLIDENE LACTONES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-10-05 WO claimed