⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9047715 | 0.76 | ALDH1A1 (0.35) | — | |
| SCHEMBL9030961 | 0.75 | CTSB (0.31) | — | |
| SCHEMBL9032059 | 0.69 | — | — | |
| SCHEMBL5634709 | 0.69 | — | — | |
| SCHEMBL8830406 | 0.63 | GRM4 (0.49) | — | |
| SCHEMBL10433054 | 0.58 | — | — | |
| SCHEMBL20900100 | 0.56 | KDM7A (0.30) | — | |
| SCHEMBL8386040 | 0.55 | — | — | |
| SCHEMBL2034380 | 0.55 | — | — | |
| SCHEMBL1863884 | 0.53 | KDM7A (0.43) | — |
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-0700912-A1 | QUINOLONE DERIVATIVE OR SALT THEREOF, AND ANTIBACTERIAL CONTAINING THE SAME | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1996-03-13 | — | — | EP | disclosed |
| US-5412098-A | Quinolone derivative or salt thereof and antibacterial containing the same | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1995-05-02 | — | — | US | disclosed |
| EP-0596126-A1 | NOVEL QUINOLONE DERIVATIVE OR SALT THEREOF AND ANTIBACTERIAL CONTAINING THE SAME | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1994-05-11 | — | — | EP | disclosed |