⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7549488 | 0.91 | TNKS (0.32) | — | |
| SCHEMBL7123408 | 0.77 | AAK1 (0.33) | — | |
| SCHEMBL7113376 | 0.66 | RORC (0.38) | — | |
| SCHEMBL7119299 | 0.63 | DHODH (0.34) | — | |
| SCHEMBL30080029 | 0.58 | ALOX5AP (0.36) | — | |
| SCHEMBL22275198 | 0.56 | CA12 (0.34) | — | |
| SCHEMBL6811874 | 0.55 | CA12 (0.56) | — | |
| SCHEMBL30079900 | 0.55 | ESR1 (0.39) | — | |
| SCHEMBL1056366 | 0.54 | ALOX5AP (0.36) | — | |
| SCHEMBL30080022 | 0.54 | HSD11B1 (0.35) | — |
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-20030069271-A1 | Quinolone compounds for use in treating viral infections | SMITHKLINE BEECHAM CORPORATION | 2003-04-10 | — | — | US | disclosed |
| EP-1244629-A2 | QUINOLONE COMPOUNDS FOR USE IN TREATING VIRAL INFECTIONS | GLAXO GROUP LIMITED (GB) | 2002-10-02 | — | — | EP | disclosed |
| WO-2001046150-A2 | QUINOLONE COMPOUNDS FOR USE IN TREATING VIRAL INFECTIONS | GLAXO GROUP LIMITED (GB) | 2001-06-28 | — | — | WO | disclosed |