⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1282073 | 0.92 | AOC3 (0.31) | — | |
| SCHEMBL1281950 | 0.90 | ALOX5AP (0.33) | — | |
| SCHEMBL1282874 | 0.89 | AOC3 (0.31) | — | |
| SCHEMBL1282961 | 0.89 | AOC3 (0.31) | — | |
| SCHEMBL1283245 | 0.87 | RET (0.34) | — | |
| SCHEMBL1282866 | 0.85 | AOC3 (0.33) | — | |
| SCHEMBL1283096 | 0.83 | AOC3 (0.31) | — | |
| SCHEMBL1283102 | 0.81 | ABL1 (0.35) | — | |
| SCHEMBL1282345 | 0.81 | MEN1 (0.34) | — | |
| SCHEMBL1282649 | 0.81 | AOC3 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9181234-B2 | Antibacterial compounds | BIOTA EUROPE LTD. (GB) | 2015-11-10 | — | — | US | disclosed |
| US-20120088750-A1 | ANTIBACTERIAL COMPOUNDS | BIOTA EUROPE LTD. (GB) | 2012-04-12 | — | — | US | disclosed |