SCHEMBL1262289

SCHEMBL1262289

CC(C)=CC1OC1(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
SCHEMBL4485613 0.69
SCHEMBL9981170 0.69
SCHEMBL20818864 0.69 ALOX15 (0.34)
SCHEMBL13815011 0.68 ALOX15 (0.31)
SCHEMBL10398855 0.63
SCHEMBL5057419 0.63
SCHEMBL10398856 0.63
SCHEMBL13455889 0.62 CA2 (0.31)
SCHEMBL1579393 0.61 ALOX15 (0.54)
SCHEMBL11221232 0.60 LSS (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
EP-1790628-B1 METHOD FOR PRODUCING UNSATURATED VICINAL DIOL COMPOUND SUMITOMO CHEMICAL CO (JP) 2012-08-01 EP disclosed
US-7880038-B2 complexing a tungsten boride and molybdenum boride, a phosphate compound, Mo and W metal, hydrogen peroxide and an amine oxide to form a catalyst, reacting an olefin with H2O2 in the pH 0 to 2 or more, in presence of above catalyst to produce carbonyl compounds by oxidative breaking of C-C bond of olefin SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-02-01 US disclosed
EP-1618953-B1 USE OF A METAL CATALYST SUMITOMO CHEMICAL CO (JP) 2010-12-08 EP disclosed
CN-100564336-C Be used to produce the method for unsaturated vicinal diol compound SUMITOMO CHEMICAL CO (JP) 2009-12-02 CN disclosed
US-7550604-B2 Pyrroloterpenes and use of the same as antimicrobial and anticancer agents NEREUS PHARMACEUTICALS, INC. (US) 2009-06-23 US disclosed
US-7550604-B2 Pyrroloterpenes and use of the same as antimicrobial and anticancer agents NEREUS PHARMACEUTICALS, INC. (US) 2009-06-23 US disclosed
US-7459588-B2 Method for producing unsaturated vicinal diol compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-12-02 US disclosed
US-20080114185-A1 Method for Producing Unsaturated Vicinal Diol Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-05-15 US disclosed
CN-101018752-A Method for producing unsaturated vicinal diol compound SUMITOMO CHEMICAL CO (JP) 2007-08-15 CN disclosed
EP-1790628-A1 METHOD FOR PRODUCING UNSATURATED VICINAL DIOL COMPOUND Sumitomo Chemical Company, Limited (JP) 2007-05-30 EP disclosed
US-20060211891-A1 Metal catalyst and its use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-09-21 US disclosed
US-7074947-B2 Process for producing epoxide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-07-11 US disclosed
EP-1618953-A1 METAL CATALYST AND ITS USE Sumitomo Chemical Company, Limited (JP) 2006-01-25 EP disclosed
US-20050020841-A1 Process for producing expoxide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-01-27 US disclosed
EP-1473290-A1 PROCESS FOR PRODUCING EPOXIDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2004-11-03 EP disclosed