⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL301246 | 1.00 | — | — | |
| SCHEMBL6751047 | 1.00 | — | — | |
| SCHEMBL3973719 | 0.94 | — | — | |
| Hydrogen Peroxide SCHEMBL7011640 | 0.94 | — | — | |
| SCHEMBL3973715 | 0.94 | — | — | |
| SCHEMBL4070883 | 0.94 | — | — | |
| SCHEMBL4070880 | 0.94 | — | — | |
| Water SCHEMBL4468314 | 0.94 | — | — | |
| Sulfurous Acid SCHEMBL2184614 | 0.94 | CA1 (0.67) | — | |
| SCHEMBL28329421 | 0.94 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105408330-A | Novel aza-oxo-indoles for the treatment and prophylaxis of respiratory syncytial virus infection | HOFFMANN LA ROCHE | 2016-03-16 | — | — | CN | disclosed |
| CN-105189495-A | Microbicidally active imidazopyridine derivatives | SYNGENTA PARTICIPATIONS AG | 2015-12-23 | — | — | CN | disclosed |