⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28299427 | 0.82 | — | — | |
| SCHEMBL28871344 | 0.82 | — | — | |
| SCHEMBL6858478 | 0.82 | — | — | |
| SCHEMBL4186755 | 0.82 | — | — | |
| SCHEMBL286246 | 0.82 | — | — | |
| SCHEMBL144514 | 0.82 | — | — | |
| Phosphine SCHEMBL9219303 | 0.78 | — | — | |
| Phosphine SCHEMBL25381658 | 0.67 | — | — | |
| Water SCHEMBL4320361 | 0.67 | — | — | |
| Hydrogen Sulfide SCHEMBL16650114 | 0.67 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0987776-B1 | Metal oxide of porous structure, electrode structure, secondary battery, and methods for producing them | CANON KK (JP) | 2007-08-22 | — | — | EP | disclosed |
| US-6558847-B1 | Metal oxide of porous structure, electrode structure, secondary battery, and methods for producing them | CANON KABUSHIKI KAISHA (JP) | 2003-05-06 | — | — | US | disclosed |
| EP-0987776-A1 | Metal oxide of porous structure, electrode structure, secondary battery, and methods for producing them | CANON KABUSHIKI KAISHA (JP) | 2000-03-22 | — | — | EP | disclosed |