⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3314392 | 0.84 | — | — | |
| SCHEMBL15024808 | 0.64 | — | — | |
| SCHEMBL6118883 | 0.61 | — | — | |
| SCHEMBL689557 | 0.60 | — | — | |
| SCHEMBL625895 | 0.60 | — | — | |
| SCHEMBL8723031 | 0.58 | — | — | |
| SCHEMBL28842548 | 0.58 | — | — | |
| SCHEMBL12978449 | 0.58 | — | — | |
| SCHEMBL8650813 | 0.57 | — | — | |
| SCHEMBL676625 | 0.57 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011073662-A1 | COMBINATION OF A BENZOXAZINONE AND A FURTHER AGENT FOR TREATING RESPIRATORY DISEASES | ASTRAZENECA AB (SE) | 2011-06-23 | — | — | WO | disclosed |
| EP-2257541-A1 | MODULATORS FOR AMYLOID BETA | F. Hoffmann-La Roche AG (CH) | 2010-12-08 | — | — | EP | disclosed |
| WO-2009103652-A1 | MODULATORS FOR AMYLOID BETA | F. HOFFMANN-LA ROCHE AG (CH) | 2009-08-27 | — | — | WO | disclosed |
| EP-0874869-A1 | AQUEOUS POLYMER/POLYURETHANE RESIN BINDER DISPERSION, ITS PREPARATION, COATING AGENT AND USE | Herberts Gesellschaft mit beschränkter Haftung (DE) | 1998-11-04 | — | — | EP | disclosed |
| WO-1997026289-A1 | AQUEOUS POLYMER/POLYURETHANE RESIN BINDER DISPERSION, ITS PREPARATION, COATING AGENT AND USE | Herberts Gesellschaft mit beschränkter Haftung (DE) | 1997-07-24 | — | — | WO | disclosed |