⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9103030 | 0.81 | MAPT (0.34) | — | |
| SCHEMBL8527157 | 0.81 | — | — | |
| SCHEMBL9102810 | 0.78 | KDM4E (0.36) | — | |
| SCHEMBL7757465 | 0.76 | TSHR (0.30) | — | |
| SCHEMBL7753370 | 0.75 | TSHR (0.32) | — | |
| SCHEMBL4392429 | 0.74 | MAPK1 (0.31) | — | |
| SCHEMBL9109535 | 0.74 | PRKCA (0.34) | — | |
| SCHEMBL7757398 | 0.73 | CA1 (0.34) | — | |
| SCHEMBL27238380 | 0.73 | LMNA (0.40) | — | |
| SCHEMBL7756989 | 0.72 | MAPK1 (0.32) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |