SCHEMBL5546103

SCHEMBL5546103

C#CC(C)(C)OO

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
SCHEMBL8698339 0.72 ELANE (0.30)
SCHEMBL374940 0.72 ALDH1A1 (0.47)
SCHEMBL134560 0.69
SCHEMBL2106177 0.67 ELANE (0.46)
SCHEMBL11924859 0.67
SCHEMBL2104500 0.67 ELANE (0.46)
SCHEMBL16693038 0.67
SCHEMBL1788916 0.67
SCHEMBL4796430 0.67
SCHEMBL7921594 0.67 ALDH1A1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3211996-A1 A METHOD OF CONTROLING MICROBIAL PATHOGENS ON LIVING PLANT TISSUE Akzo Nobel Chemicals International B.V. (NL) 2017-09-06 EP disclosed
WO-2016066568-A1 A METHOD OF CONTROLING MICROBIAL PATHOGENS ON LIVING PLANT TISSUE AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2016-05-06 WO disclosed
EP-0879224-B2 NOVEL POLY(MONOPEROXYCARBONATES) ARKEMA INC (US) 2013-12-25 EP disclosed
EP-1382596-B1 Novel poly (monoperoxycarbonates) ARKEMA INC (US) 2007-02-14 EP disclosed
EP-1382596-A1 Novel poly (monoperoxycarbonates) Atofina Chemicals, Inc. (US) 2004-01-21 EP disclosed
EP-0879224-B1 NOVEL POLY(MONOPEROXYCARBONATES) ATOFINA CHEM INC (US) 2003-10-22 EP disclosed
EP-0850928-B1 Novel peroxyoxalates derived from hydroxy-hydroperoxides ATOFINA CHEM INC (US) 2001-10-31 EP disclosed
EP-0606096-B1 OO-t-alkyl O-polycaprolactone monoperoxycarbonates ATOFINA CHEM INC (US) 2001-09-12 EP disclosed
EP-0850929-B1 Novel bis(mono- and diperoxy-oxalates) derived from dihydroperoxides and alkyl and alkylperoxy halooxalates ATOFINA CHEM INC (US) 2001-06-27 EP disclosed
US-5981787-A INITIATORS FOR POLYMERIZING ETHYLENICALLY UNSATURATED MONOMERS AND FOR CURING OF UNSATURATED POLYESTER RESINS ELF ATOCHEM NORTH AMERICA, INC. (US) 1999-11-09 US disclosed
US-4486580-A VINYL CHLORIDE, UNSATURATED POLYESTERS PENNWALT CORPORATION (US) 1984-12-04 US disclosed
US-4241222-A CROSSLINKING AGENTS PENNWALT CORPORATION (US) 1980-12-23 US disclosed
US-4219676-A FREE RADICAL POLYMERIZATION CATALYSTS PENNWALT CORPORATION (US) 1980-08-26 US disclosed
US-4218548-A Peroxy compounds and vulcanizable compositions thereof PENNWALT CORPORATION (US) 1980-08-19 US disclosed
US-4180518-A CROSSLINKING OR VULCANIZING AGENTS PENNWALT CORPORATION (US) 1979-12-25 US disclosed
US-4177204-A AGENTS FOR CROSSLINKING OR VULCANIZING POLYMERS PENNWALT CORPORATION (US) 1979-12-04 US disclosed
US-4129700-A Peroxy compounds and vulcanizable compositions thereof PENNWALT CORPORATION (US) 1978-12-12 US disclosed
US-4079074-A FREE RADICAL CATALYSTS, CURING AGENTS FOR UNSATURATED POLYESTERS PENNWALT CORPORATION (US) 1978-03-14 US disclosed
US-3980629-A CROSSLINKING PLASTOMERS, VULCANIZING ELASTOMERS, INITIATORS FOR RADICAL POLYMERIZATIONS THE B. F. GOODRICH COMPANY (US) 1976-09-14 US disclosed
US-3956319-A CROSSLINKING ELASTOMER, VULCANIZATION, POLYMERIZATION CATALYST THE B. F. GOODRICH COMPANY (US) 1976-05-11 US disclosed