⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5604835 | 0.79 | — | — | |
| SCHEMBL5604290 | 0.77 | — | — | |
| SCHEMBL9720444 | 0.76 | KDM4E (0.33) | — | |
| SCHEMBL312626 | 0.74 | — | — | |
| SCHEMBL9720474 | 0.74 | KDM4E (0.31) | — | |
| SCHEMBL9720448 | 0.74 | ALDH1A1 (0.34) | — | |
| SCHEMBL9720449 | 0.71 | CCR4 (0.33) | — | |
| SCHEMBL73851 | 0.69 | — | — | |
| SCHEMBL7952376 | 0.67 | — | — | |
| SCHEMBL510598 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5169853-A | Antibacterial agents; administering to mammals for infection | STERLING DRUG INC. (US) | 1992-12-08 | — | — | US | disclosed |
| US-5075319-A | Bactericides | STERLING DRUG INC. (US) | 1991-12-24 | — | — | US | disclosed |
| EP-0417669-A2 | Pyridinyl-quinolone compounds, their preparation and use | STERLING WINTHROP INC. (US) | 1991-03-20 | — | — | EP | disclosed |