⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3873198 | 0.71 | — | — | |
| SCHEMBL27521150 | 0.66 | — | — | |
| SCHEMBL10607707 | 0.62 | GAA (0.33) | — | |
| SCHEMBL4777824 | 0.58 | — | — | |
| SCHEMBL11181161 | 0.55 | — | — | |
| SCHEMBL15272787 | 0.55 | — | — | |
| SCHEMBL2357982 | 0.55 | — | — | |
| SCHEMBL1140868 | 0.54 | — | — | |
| Allylamine SCHEMBL10783854 | 0.54 | — | — | |
| SCHEMBL22604395 | 0.53 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5157128-A | Antibacterial agents | WARNER-LAMBERT COMPANY (US) | 1992-10-20 | — | — | US | disclosed |