⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13681785 | 0.73 | — | — | |
| SCHEMBL16653484 | 0.67 | — | — | |
| SCHEMBL21200950 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL21805905 | 0.65 | — | — | |
| SCHEMBL2397314 | 0.62 | — | — | |
| SCHEMBL26993337 | 0.62 | — | — | |
| SCHEMBL530755 | 0.61 | RECQL (0.30) | — | |
| SCHEMBL3409515 | 0.61 | — | — | |
| SCHEMBL15726605 | 0.61 | — | — | |
| SCHEMBL3407581 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5556861-A | 1,8 benzonaphthyridine derivatives and antimicrobial compositions | LABORATOIRE ROGER BELLON (FR) | 1996-09-17 | — | — | US | disclosed |