SCHEMBL7787915

SCHEMBL7787915

CC(C)(C)OC(=O)C1OOC1O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.36
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
EPHX2 P34913 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
DGAT1 O75907 1/20 0.31
RECQL P46063 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL1191602 0.78 MAPK1 (0.40) MAPK1DGAT1
SCHEMBL9015733 0.77 MAPK1 (0.35) MAPK1CHRM2CHRM1CHRM3DGAT1
SCHEMBL18176808 0.77 MAPK1 (0.40) MAPK1USP2SMN1; SMN2HRH3CHRM2
SCHEMBL12309462 0.77 MAPK1 (0.40) MAPK1USP2SMN1; SMN2HRH3CHRM2
SCHEMBL30490352 0.74 MAPK1 (0.33) MAPK1USP2SMN1; SMN2
SCHEMBL14968136 0.73 MAPK1 (0.42) MAPK1USP2SMN1; SMN2HRH3DGAT1
SCHEMBL27094496 0.71 MAPK1 (0.41) MAPK1USP2SMN1; SMN2HRH3DGAT1
SCHEMBL16272964 0.70 MAPK1 (0.43) MAPK1DGAT1
SCHEMBL28431731 0.67 MAPK1 (0.34) MAPK1
SCHEMBL14966926 0.67 MAPK1 (0.34) MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0850928-B1 Novel peroxyoxalates derived from hydroxy-hydroperoxides ATOFINA CHEM INC (US) 2001-10-31 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
EP-0850928-A1 Novel peroxyoxalates derived from hydroxy-hydroperoxides ELF ATOCHEM NORTH AMERICA, INC. (US) 1998-07-01 EP disclosed
US-5451654-A Addition polymerization catalyst ELF ATOCHEM NORTH AMERICA, INC. (US) 1995-09-19 US disclosed
US-5387654-A Hydroxy-peroxides and their uses ELF ATOCHEM NORTH AMERICA, INC. (US) 1995-02-07 US disclosed
EP-0381135-B1 Novel hydroxy-peroxides and their uses ATOCHEM NORTH AMERICA (US) 1994-06-01 EP disclosed
US-5304649-A Curing agent for unsaturated polyesters ELF ATOCHEM NORTH AMERICA, INC. (US) 1994-04-19 US disclosed
EP-0381135-A2 Novel hydroxy-peroxides and their uses ATOCHEM NORTH AMERICA, INC. (US) 1990-08-08 EP disclosed