⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12837936 | 0.67 | — | — | |
| SCHEMBL13455183 | 0.67 | — | — | |
| SCHEMBL15545078 | 0.62 | — | — | |
| SCHEMBL16915027 | 0.57 | — | — | |
| SCHEMBL4434563 | 0.56 | — | — | |
| SCHEMBL15352383 | 0.55 | — | — | |
| SCHEMBL744461 | 0.55 | — | — | |
| SCHEMBL14616110 | 0.55 | — | — | |
| SCHEMBL601185 | 0.55 | — | — | |
| SCHEMBL18010961 | 0.52 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017223349-A1 | ANTIBACTERIAL AGENTS | ACHAOGEN, INC. (US) | 2017-12-28 | — | — | WO | disclosed |