⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL402869 | 0.85 | — | — | |
| SCHEMBL403872 | 0.85 | — | — | |
| SCHEMBL4531423 | 0.85 | — | — | |
| SCHEMBL1109389 | 0.83 | HDAC6 (0.43) | — | |
| SCHEMBL20299903 | 0.80 | — | — | |
| SCHEMBL20299905 | 0.80 | — | — | |
| SCHEMBL403992 | 0.77 | ACACB (0.54) | — | |
| SCHEMBL404041 | 0.77 | ACACB (0.54) | — | |
| SCHEMBL13655066 | 0.77 | GRM5 (0.47) | — | |
| SCHEMBL404076 | 0.76 | GRM5 (0.43) | — |
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-8153843-B2 | Antibacterial agents | UNIVERSITY OF WASHINGTON (US) | 2012-04-10 | — | — | US | disclosed |
| US-20100324025-A1 | Antibacterial Agents | UNIVERSITY OF WASHINGTON (US) | 2010-12-23 | — | — | US | disclosed |