⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9569214 | 0.90 | — | — | |
| SCHEMBL9569229 | 0.87 | CCR8 (0.30) | — | |
| SCHEMBL9569210 | 0.76 | CCR8 (0.35) | — | |
| SCHEMBL9529665 | 0.71 | CCR8 (0.39) | — | |
| SCHEMBL13457678 | 0.65 | MAOA (0.39) | — | |
| SCHEMBL1886773 | 0.64 | CCR8 (0.52) | — | |
| SCHEMBL21050882 | 0.60 | CCR8 (0.47) | — | |
| SCHEMBL29431923 | 0.59 | ALK (0.38) | — | |
| SCHEMBL3925048 | 0.58 | CCR8 (0.44) | — | |
| SCHEMBL19890539 | 0.57 | CCR8 (0.55) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0541086-A1 | Antibacterial 6-fluoro-quinolones having an oxime group on the substituent in position 7 | Kaken Pharmaceutical Co., Ltd. (JP) | 1993-05-12 | — | — | EP | disclosed |