SCHEMBL1040994

SCHEMBL1040994

C[C@@H](O)COC(C)(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
SCHEMBL35599 1.00
SCHEMBL2087163 1.00
Propane SCHEMBL28856185 0.95 MAPK1 (0.90)
Tert-Butanol SCHEMBL5520538 0.95 MAPK1 (0.90)
Propylene Glycol SCHEMBL28059743 0.92 MAPK1 (0.85)
Acetic Acid SCHEMBL3250234 0.90 MAPK1 (0.81)
SCHEMBL3159735 0.88 MAPK1 (0.77)
SCHEMBL78969 0.83 MAPK1 (0.70)
SCHEMBL12336887 0.82 MAPK1 (0.68)
SCHEMBL350593 0.81 MAPK1 (0.67)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7264960-B2 Enzymatic resolution of propylene glycol alkyl (or aryl) ethers and ether acetates DOW GLOBAL TECHNOLOGIES INC. (US) 2007-09-04 US claimed
US-20050026260-A1 Enzymatic resolution of propylene glycol alkyl (or aryl) ethers and ether acetates RESNICK SOL M (US) 2005-02-03 US claimed
EP-1490501-A2 ENZYMATIC RESOLUTION OF PROPYLENE GLYCOL ALKYL (OR ARYL) ETHERS AND ETHER ACETATES Dow Global Technologies Inc. (US) 2004-12-29 EP claimed
WO-2003083126-A2 ENZYMATIC RESOLUTION OF PROPYLENE GLYCOL ALKYL (OR ARYL) ETHERS AND ETHER ACETATES DOW GLOBAL TECHNOLOGIES INC. (US) 2003-10-09 WO claimed
US-9206174-B2 5-anilinoimidazopyridines and methods of use GENENTECH, INC. (US) 2015-12-08 US disclosed
US-9206174-B2 5-anilinoimidazopyridines and methods of use GENENTECH, INC. (US) 2015-12-08 US disclosed
US-8841462-B2 Bicyclic heterocycles as MEK kinase inhibitors GENENTECH, INC. 2014-09-23 US disclosed
US-8841462-B2 Bicyclic heterocycles as MEK kinase inhibitors GENENTECH, INC. 2014-09-23 US disclosed
US-8492427-B2 Isoindolones derivatives as MEK kinase inhibitors and methods of use GENENTECH, INC. (US) 2013-07-23 US disclosed
US-8486963-B2 Azaindolizines and methods of use GENENTECH, INC. (US) 2013-07-16 US disclosed
US-8486963-B2 Azaindolizines and methods of use GENENTECH, INC. (US) 2013-07-16 US disclosed
US-20130150584-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE GENENTECH, INC. (US) 2013-06-13 US disclosed
US-20080085886-A1 Anticancer and/or antiinflammatory activity, MEK (MAP kinase kinase) inhibitors; for example, 3-(2-Fluoro-4-iodo-phenylamino)-furo[3,2-c]pyridine-2-carboxylic acid ((R)-2,3-dihydroxy-propoxy)-amide GENENTECH, INC. 2008-04-10 US disclosed
US-20080085886-A1 Anticancer and/or antiinflammatory activity, MEK (MAP kinase kinase) inhibitors; for example, 3-(2-Fluoro-4-iodo-phenylamino)-furo[3,2-c]pyridine-2-carboxylic acid ((R)-2,3-dihydroxy-propoxy)-amide GENENTECH, INC. 2008-04-10 US disclosed
US-20080081821-A1 AZA-benzothiophenyl compounds and methods of use GENENTECH, INC. 2008-04-03 US disclosed
US-20080081821-A1 AZA-benzothiophenyl compounds and methods of use GENENTECH, INC. 2008-04-03 US disclosed
US-7264960-B2 Enzymatic resolution of propylene glycol alkyl (or aryl) ethers and ether acetates DOW GLOBAL TECHNOLOGIES INC. (US) 2007-09-04 US disclosed
US-20050026260-A1 Enzymatic resolution of propylene glycol alkyl (or aryl) ethers and ether acetates RESNICK SOL M (US) 2005-02-03 US disclosed
EP-1490501-A2 ENZYMATIC RESOLUTION OF PROPYLENE GLYCOL ALKYL (OR ARYL) ETHERS AND ETHER ACETATES Dow Global Technologies Inc. (US) 2004-12-29 EP disclosed
WO-2003083126-A2 ENZYMATIC RESOLUTION OF PROPYLENE GLYCOL ALKYL (OR ARYL) ETHERS AND ETHER ACETATES DOW GLOBAL TECHNOLOGIES INC. (US) 2003-10-09 WO disclosed