SCHEMBL4975683

SCHEMBL4975683

CC(C)CC(O)CC(C)COB(OCC(C)CC(O)CC(C)C)OCC(C)CC(O)CC(C)C

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
SCHEMBL2324898 0.84 ALDH1A1 (0.30)
Boric Acid SCHEMBL9714164 0.75 ANPEP (0.46)
SCHEMBL232113 0.73 TSHR (0.33)
SCHEMBL22456 0.72 TSHR (0.41)
SCHEMBL17642229 0.69 TSHR (0.39)
SCHEMBL28217454 0.69 TSHR (0.39)
Hydrogen Peroxide SCHEMBL28104525 0.69 RNPEP (0.41)
SCHEMBL12837680 0.69 TSHR (0.40)
SCHEMBL3310241 0.69 TSHR (0.42)
SCHEMBL108316 0.69 TSHR (0.40)

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9327423-B2 Wood preservatives and methods for treating wood LIQUID LIGNIN COMPANY, LLC (US) 2016-05-03 US claimed
US-20150189870-A1 WOOD PRESERVATIVES AND METHODS FOR TREATING WOOD LIQUID LIGNIN COMPANY, LLC (US) 2015-07-09 US claimed
US-20080063884-A1 METHOD FOR TREATING WOOD MEADWESTVACO CORPORATION 2008-03-13 US claimed
JP-2637810-B2 1997-08-06 JP claimed
EP-0335940-B1 PRESERVATIVE ELEMENTS CONTAINING ORGANIC BORON COMPOUNDS AND THEIR USE MANCHEM LIMITED (GB) 1992-04-15 EP claimed
US-4911988-A For timber and masonry MANCHEM LIMITED (GB) 1990-03-27 US claimed
EP-0335940-A1 PRESERVATIVE ELEMENTS CONTAINING ORGANIC BORON COMPOUNDS AND THEIR USE MANCHEM LIMITED (GB) 1989-10-11 EP claimed
WO-1989003287-A1 PRESERVATIVE ELEMENTS CONTAINING ORGANIC BORON COMPOUNDS AND THEIR USE MANCHEM LIMITED (GB) 1989-04-20 WO claimed
US-9327423-B2 Wood preservatives and methods for treating wood LIQUID LIGNIN COMPANY, LLC (US) 2016-05-03 US disclosed
US-20150189870-A1 WOOD PRESERVATIVES AND METHODS FOR TREATING WOOD LIQUID LIGNIN COMPANY, LLC (US) 2015-07-09 US disclosed
US-20080063884-A1 METHOD FOR TREATING WOOD MEADWESTVACO CORPORATION 2008-03-13 US disclosed
EP-0335940-B1 PRESERVATIVE ELEMENTS CONTAINING ORGANIC BORON COMPOUNDS AND THEIR USE MANCHEM LIMITED (GB) 1992-04-15 EP disclosed
US-4911988-A For timber and masonry MANCHEM LIMITED (GB) 1990-03-27 US disclosed
EP-0335940-A1 PRESERVATIVE ELEMENTS CONTAINING ORGANIC BORON COMPOUNDS AND THEIR USE MANCHEM LIMITED (GB) 1989-10-11 EP disclosed
WO-1989003287-A1 PRESERVATIVE ELEMENTS CONTAINING ORGANIC BORON COMPOUNDS AND THEIR USE MANCHEM LIMITED (GB) 1989-04-20 WO disclosed