⚠ 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7790694 | 0.83 | — | — | |
| SCHEMBL11360839 | 0.78 | — | — | |
| SCHEMBL4189933 | 0.78 | — | — | |
| SCHEMBL7791410 | 0.77 | TSHR (0.32) | — | |
| SCHEMBL8071873 | 0.76 | — | — | |
| SCHEMBL8740218 | 0.74 | HCAR2 (0.33) | — | |
| SCHEMBL8740216 | 0.74 | HCAR2 (0.33) | — | |
| SCHEMBL9842683 | 0.73 | TSHR (0.32) | — | |
| SCHEMBL3830066 | 0.73 | — | — | |
| SCHEMBL10694903 | 0.73 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0850928-B1 | Novel peroxyoxalates derived from hydroxy-hydroperoxides | ATOFINA CHEM INC (US) | 2001-10-31 | — | — | 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-5837782-A | POLYMERIZATION CATALYST | ELF ATOCHEM NORTH AMERICA, INC. (US) | 1998-11-17 | — | — | US | disclosed |
| EP-0850928-A1 | Novel peroxyoxalates derived from hydroxy-hydroperoxides | ELF ATOCHEM NORTH AMERICA, INC. (US) | 1998-07-01 | — | — | EP | disclosed |
| EP-0850929-A1 | Novel bis(mono- and diperoxy-oxalates) derived from dihydroperoxides and alkyl and alkylperoxy halooxalates | ELF ATOCHEM NORTH AMERICA, INC. (US) | 1998-07-01 | — | — | EP | disclosed |