⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6779605 | 0.93 | KDM4E (0.46) | — | |
| SCHEMBL6777194 | 0.86 | — | — | |
| SCHEMBL4741925 | 0.84 | — | — | |
| SCHEMBL11967710 | 0.84 | — | — | |
| SCHEMBL4743088 | 0.84 | — | — | |
| SCHEMBL11967818 | 0.84 | — | — | |
| SCHEMBL11967746 | 0.83 | — | — | |
| SCHEMBL11967768 | 0.83 | — | — | |
| SCHEMBL4741950 | 0.83 | — | — | |
| SCHEMBL6778740 | 0.83 | — | — |
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-1401829-B1 | NOVEL HETEROCYCLIC ANTIBACTERIAL COMPOUNDS | MICROBIOTIX INC (US) | 2012-08-22 | — | — | EP | disclosed |