SCHEMBL534025

SCHEMBL534025

C=CCCC/C=C/CN

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
SCHEMBL534026 1.00
SCHEMBL23367713 1.00
SCHEMBL6731505 0.85 ALDH1A1 (0.50)
SCHEMBL9327352 0.85 GABRR1 (0.32)
SCHEMBL6720513 0.85 ALDH1A1 (0.50)
SCHEMBL6720512 0.85 ALDH1A1 (0.50)
SCHEMBL6731503 0.85 ALDH1A1 (0.50)
SCHEMBL9327358 0.85 GABRR1 (0.32)
SCHEMBL1485746 0.82
SCHEMBL6727431 0.82 TSHR (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7030286-B2 Reacting 1,3-butadiene with a telogen such as methanol, using a telomerization catalyst to form a telomer, partially hydrogenating the telomer to form a 1-substituted 2-octene and dissociating it to give 1-octene OXENO OLEFINCHEMIE GMBH (DE) 2006-04-18 US claimed
EP-1358140-B1 METHOD FOR PRODUCING 1-OCTEN OXENO OLEFINCHEMIE GMBH (DE) 2004-12-29 EP claimed
US-20040059170-A1 Method for producing 1-octen OXENO OLEFINCHEMIE GMBH (DE) 2004-03-25 US claimed
EP-1358140-A1 METHOD FOR PRODUCING 1-OCTEN Oxeno Olefinchemie GmbH (DE) 2003-11-05 EP claimed
WO-2002062732-A1 METHOD FOR PRODUCING 1-OCTEN OXENO OLEFINCHEMIE GMBH (DE) 2002-08-15 WO claimed
EP-1781586-B1 METHOD FOR THE TELOMERIZATION OF NON-CYCLIC OLEFINS EVONIK DEGUSSA GMBH (DE) 2014-05-14 EP disclosed
WO-2012038197-A1 COATING AGENT HAVING (METH)ACRYLIC POLYMERS AND COALESCENCE ADDITIVES EVONIK RÖHM GMBH (DE) 2012-03-29 WO disclosed
EP-1976619-B1 METHOD FOR THE ELIMINATION OF METAL COMPLEX CATALYSTS FROM TELOMERIZATION MIXTURES EVONIK OXENO GMBH (DE) 2012-02-08 EP disclosed
US-7977520-B2 Method for the telomerization of non-cyclic olefins EVONIX OXENO GmbH (DE) 2011-07-12 US disclosed
EP-1781587-B1 METHOD FOR THE TELOMERIZATION OF NON-CYCLIC OLEFINS EVONIK OXENO GMBH (DE) 2011-03-02 EP disclosed
WO-2010112288-A1 COATING AGENT, METHOD FOR PRODUCING A COATING AND COATED OBJECT EVONIK RÖHM GMBH (DE) 2010-10-07 WO disclosed
US-7758897-B2 Method for the production of metal complexes EVONIK OXENO GMBH (DE) 2010-07-20 US disclosed
US-20020183196-A1 Phosphonium salts and processes for production of and uses for the same, and phosphines deriving the same and processes for production of the phosphines KURARAY CO. LTD, (JP) 2002-12-05 US disclosed
EP-1249455-A1 Phosphonium salts and processes for production of and uses for the same, and phosphines deriving the same and processes for production of the phosphines Kuraray Co., Ltd. (JP) 2002-10-16 EP disclosed
WO-2002062732-A1 METHOD FOR PRODUCING 1-OCTEN OXENO OLEFINCHEMIE GMBH (DE) 2002-08-15 WO disclosed
EP-0939074-A3 Process for the preparation of octa-2,7-dienyl-amine from butadiene and ammonia in presence of palladium-complex catalysts Bayer Aktiengesellschaft (DE) 2000-05-03 EP disclosed
EP-0939074-A2 Process for the preparation of octa-2,7-dienyl-amine from butadiene and ammonia in presence of palladium-complex catalysts Bayer Aktiengesellschaft (DE) 1999-09-01 EP disclosed
US-4130590-A FROM CONJUGATED DIENES AND AMMONIA OR AN AMINE, PALLADIUM COMPOUND-PHOSPHONITE CATALYST MONSANTO COMPANY (US) 1978-12-19 US disclosed
US-4100196-A AMINATION OF CONJUGATED DIENES IN A HYDROXYLIC SOLVENT AND PALLADIUM CATALYST MONSANTO COMPANY (US) 1978-07-11 US disclosed
US-4100194-A REACTIONNOF CONJUGATED DIENES WITH AMMONIA AND AMINES IN HYDROXYLIC SOLVENT MONSANTO COMPANY (US) 1978-07-11 US disclosed