SCHEMBL461289

SCHEMBL461289

C=CCC(CC=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
SCHEMBL461540 0.84
SCHEMBL6935718 0.77 TSHR (0.36)
SCHEMBL7519413 0.71
SCHEMBL7203156 0.71
SCHEMBL14237028 0.69 GRIK1 (0.30)
SCHEMBL9751230 0.67
SCHEMBL18369707 0.63
SCHEMBL4945053 0.62
SCHEMBL7074742 0.62 TSHR (0.38)
SCHEMBL5881412 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816555-B2 containing a mole ratio of amine oxide surfactant to peroxycarboxylic acid of 2 or more; disinfecting food processing and health care surfaces, plants, a body or stream of water and gas, hospitality, industrial and agricultural surfaces; antimicrobial use ECOLAB INC. (US) 2010-10-19 US claimed
US-20100022644-A1 PEROXYCARBOXYLIC ACID COMPOSITIONS WITH REDUCED ODOR ECOLAB INC. (US) 2010-01-28 US claimed
EP-1298997-B1 Use of compositions comprising a boron compound and an amine oxide as a wood preservative and waterproofer for wood LONZA AG (US) 2007-03-14 EP claimed
EP-1185401-B1 ISOTHIAZOLONE/AMINE OXIDE WOOD PRESERVATIVES LONZA AG (US) 2006-04-05 EP claimed
EP-1185402-B1 AZOLE/AMINE OXIDE WOOD PRESERVATIVES AND FUNGICIDES LONZA AG (US) 2005-03-02 EP claimed
WO-2004067485-A2 PEROXYCARBOXYLIC ACID COMPOSITIONS WITH REDUCED ODOR ECOLAB INC. (US) 2004-08-12 WO claimed
US-20040143133-A1 Peroxycarboxylic acid compositions with reduced odor ECOLAB USA INC. 2004-07-22 US claimed
US-6572788-B2 Low toxicity, high stability in water, low corrosivity metals, penetration and uniform distribution into wood, low odor, waterproofing properties LONZA, INC. 2003-06-03 US claimed
EP-1298997-A2 COMPOSITIONS COMPRISING A BORON COMPOUND AND AN AMINE OXIDE LONZA INC. (US) 2003-04-09 EP claimed
EP-1294547-A1 AMINE OXIDE WOOD PRESERVATIVES LONZA INC. (US) 2003-03-26 EP claimed
US-6448279-B1 PRESERVING AND/OR WATERPROOFING WOOD; IMPROVED LEACH RESISTANCE; SINGLE SOLUTION; LOW VOLATILITY LONZA INC. 2002-09-10 US claimed
US-20020065206-A1 Boron compound/amine oxide compositions LONZA INC. 2002-05-30 US claimed
EP-1185401-A1 ISOTHIAZOLONE/AMINE OXIDE WOOD PRESERVATIVES LONZA INC. (US) 2002-03-13 EP claimed
EP-1185402-A1 AZOLE/AMINE OXIDE WOOD PRESERVATIVES LONZA INC. (US) 2002-03-13 EP claimed
US-20020026883-A1 Amine oxide wood preservatives LONZA INC. 2002-03-07 US claimed
WO-2002001958-A2 COMPOSITIONS COMPRISING A BORON COMPOUND AND AN AMINE OXIDE LONZA INC. (US) 2002-01-10 WO claimed
WO-2001089779-A1 AMINE OXIDE WOOD PRESERVATIVES LONZA INC. (US) 2001-11-29 WO claimed
WO-2000071314-A1 AZOLE/AMINE OXIDE WOOD PRESERVATIVES LONZA INC. (US) 2000-11-30 WO claimed
WO-2000071313-A1 ISOTHIAZOLONE/AMINE OXIDE WOOD PRESERVATIVES LONZA INC. (US) 2000-11-30 WO claimed
WO-1993021766-A1 QUATERNARY AMMONIUM COMPOSITION AND PROCESS ETHYL CORPORATION (US) 1993-11-11 WO claimed