SCHEMBL609904

SCHEMBL609904

CC(=O)C#CC(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
SCHEMBL10044875 0.84
SCHEMBL16885819 0.82 LMNA (0.39)
SCHEMBL26114372 0.82
SCHEMBL9063447 0.79 FFAR3 (0.35)
SCHEMBL28411569 0.79
SCHEMBL936359 0.79
SCHEMBL25187294 0.77
SCHEMBL10136741 0.77
SCHEMBL14907648 0.76
SCHEMBL4191629 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2442783-B1 NOVEL DEODORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME ROBERTET SA (FR) 2017-08-09 EP claimed
US-9650374-B2 Photochromic tetrahydroindolizines UMM AL-QURA UNIVERSITY (SA) 2017-05-16 US claimed
WO-2016067069-A1 NOVEL PHOTOCHROMIC TETRAHYDROINDOLIZINES UMM AL-QURA UNIVERSITY (SA) 2016-05-06 WO claimed
US-20160122338-A1 NOVEL PHOTOCHROMIC TETRAHYDROINDOLIZINES UMM AL-QURA UNIVERSITY (SA) 2016-05-05 US claimed
US-9265852-B2 Deordorising compositions and deodorising products containing same ROBERTET S.A. (FR) 2016-02-23 US claimed
US-20120201778-A1 NOVEL DEORDORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME ROBERTET S.A. (FR) 2012-08-09 US claimed
EP-2442783-A2 NOVEL DEODORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME Robertet S.A. (FR) 2012-04-25 EP claimed
WO-2010146258-A2 NOVEL DEODORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME ROBERTET S.A. (FR) 2010-12-23 WO claimed
EP-1654207-B1 BIS(2-ACENYL)ACETYLENE SEMICONDUCTORS 3M INNOVATIVE PROPERTIES CO (US) 2007-08-22 EP claimed
US-7193291-B2 Organic Schottky diode 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-03-20 US claimed
EP-1738422-A1 ORGANIC SCHOTTKY DIODE WITH P-DOPED SEMICONDUCTOR BETWEEN INTRINSIC SEMICONDUCTOR AND OHMIC CONTACT 3M Innovative Properties Company (US) 2007-01-03 EP claimed
US-7109519-B2 Bis(2-acenyl)acetylene semiconductors 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-09-19 US claimed
EP-1654207-A1 BIS(2-ACENYL)ACETYLENE SEMICONDUCTORS 3M Innovative Properties Company (US) 2006-05-10 EP claimed
WO-2005104262-A1 ORGANIC SCHOTTKY DIODE WITH P-DOPED SEMICONDUCTOR BETWEEN INTRINSIC SEMICONDUCTOR AND OHMIC CONTACT 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-11-03 WO claimed
US-20050212072-A1 Organic Schottky diode 3M INNOVATIVE PROPERTIES COMPANY 2005-09-29 US claimed
WO-2005014511-A1 BIS(2-ACENYL)ACETYLENE SEMICONDUCTORS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-02-17 WO claimed
US-20050012090-A1 Bis(2-acenyl)acetylene semiconductors 3M INNOVATIVE PROPERTIES COMPANY 2005-01-20 US claimed
JP-60152435-A None JP disclosed
US-5334505-A For colorimetric determination of hydrolases BOEHRINGER MANNHEIM GMBH (DE) 1994-08-02 US disclosed
JP-S60152435-A 2,3-DIACETYLNORBORNADIENE AND ITS PREPARATION DAINIPPON INK & CHEM INC 1985-08-10 JP disclosed