SCHEMBL279658

SCHEMBL279658

C=C(CC(C)=O)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
SCHEMBL28595955 0.81
SCHEMBL4605481 0.79
SCHEMBL6656723 0.79
SCHEMBL13398763 0.77
SCHEMBL27475336 0.77
SCHEMBL2454388 0.75
SCHEMBL11303419 0.75
SCHEMBL10239632 0.75 MGAM (0.55)
SCHEMBL13657836 0.75 TDP1 (0.45)
SCHEMBL20326590 0.75 MCL1 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170335034-A1 Processes to Form Ethylene-Based Polymers Using Asymmetrical Polyenes DOW BENELUX B.V. (NL) 2017-11-23 US disclosed
US-20170282169-A1 ALUMINUM CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 2017-10-05 US disclosed
US-9751964-B2 Processes to improve reactor stability for the preparation of ethylene-based polymers using asymmetrical polyenes DOW GLOBAL TECHNOLOGIES LLC (US) 2017-09-05 US disclosed
US-20170240494-A1 METHOD AND DEVICE FOR SEPARATING A SUBSTANCE OUT OF A SOLUTION BASF SE (DE) 2017-08-24 US disclosed
US-9718906-B2 Processes to form ethylene-based polymers using asymmetrical polyenes DOW GLOBAL TECHNOLOGIES LLC (US) 2017-08-01 US disclosed
US-20160304643-A1 PROCESSES TO IMPROVE REACTOR STABILITY FOR THE PREPARATION OF ETHYLENE-BASED POLYMERS USING ASYMMETRICAL POLYENES DOW GLOBAL TECHNOLOGIES LLC 2016-10-20 US disclosed
US-20160297904-A1 Processes to Form Ethylene-Based Polymers Using Asymmetrical Polyenes DOW BENELUX B.V. (NL) 2016-10-13 US disclosed
US-20160297736-A1 Inhibitor Combination for Lithium Salt-Catalyzed Transesterification Process and Method for Removing Lithium Salt DOW GLOBAL TECHNOLOGIES LLC 2016-10-13 US disclosed
US-20150329452-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ISOPULEGOL AND OPTICALLY ACTIVE MENTHOL TAKASAGO INTERNATIONAL CORPORATION (JP) 2015-11-19 US disclosed
US-20150315110-A1 ALUMINUM CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 2015-11-05 US disclosed
US-20120202756-A1 USE OF PRODRUGS TO AVOID GI MEDIATED ADVERSE EVENTS FRANKLIN RICHARD (GB) 2012-08-09 US disclosed
WO-2012046062-A1 USE OF PRODRUGS TO AVOID GI MEDIATED ADVERSE EVENTS SHIRE, LLC (US) 2012-04-12 WO disclosed
US-8134034-B2 Recovery of bis(diarylphenol) ligands during the production of isopulegol BASF SE (DE) 2012-03-13 US disclosed
US-20110295031-A1 ORGANOALUMINUM COMPOUND TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-12-01 US disclosed
US-20110065796-A1 PRODRUGS OF GUANFACINE SHIRE LLC (US) 2011-03-17 US disclosed
WO-2010112942-A1 NOVEL DICARBOXYLIC ACID LINKED AMINO ACID AND PEPTIDE PRODRUGS OF OPIOIDS AND USES THEREOF SHIRE LLC (US) 2010-10-07 WO disclosed
US-7687549-B2 Carboxylic acid compounds and polyester oligomers and polymers made therefrom CARGILL, INCORPORATED (US) 2010-03-30 US disclosed
US-20100010253-A1 RECOVERY OF BIS(DIARYLPHENOL) LIGANDS DURING THE PRODUCTION OF ISOPULEGOL BASF SE (DE) 2010-01-14 US disclosed
US-20080146690-A1 Carboxylic Acid Compounds and Polyester Oligomers and Polymers Made Therefrom CARGILL, INCORPORATED (US) 2008-06-19 US disclosed
US-7256250-B2 Biodegradable coating JVS-POLYMERS OY (FI) 2007-08-14 US disclosed