⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL407240 | 0.79 | — | — | |
| SCHEMBL13100928 | 0.77 | — | — | |
| SCHEMBL16895018 | 0.69 | — | — | |
| SCHEMBL27340 | 0.67 | — | — | |
| SCHEMBL13921722 | 0.67 | — | — | |
| SCHEMBL13921721 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL2306141 | 0.64 | — | — | |
| SCHEMBL2306976 | 0.64 | — | — | |
| SCHEMBL3725238 | 0.64 | — | — | |
| SCHEMBL3724481 | 0.64 | — | — |
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-7462605-B2 | Phosphoramidate compounds and methods of use | CELMED ONCOLOGY (USA), INC. (CA) | 2008-12-09 | — | — | US | disclosed |