⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13370811 | 0.87 | — | — | |
| SCHEMBL2016332 | 0.86 | — | — | |
| SCHEMBL2017827 | 0.86 | — | — | |
| SCHEMBL2019758 | 0.84 | — | — | |
| SCHEMBL12985070 | 0.84 | — | — | |
| SCHEMBL17453162 | 0.82 | — | — | |
| SCHEMBL2020157 | 0.78 | MAPK14 (0.55) | — | |
| SCHEMBL18954060 | 0.77 | GRM2 (0.43) | — | |
| SCHEMBL12984743 | 0.77 | — | — | |
| SCHEMBL18953866 | 0.76 | — | — |
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-2019178305-A1 | PYRIDINONE AND PYRIMIDINONE PHOSPHATES AND BORONATES USEFUL AS ANTIBACTERIAL AGENTS | PFIZER INC. (US) | 2019-09-19 | — | — | WO | disclosed |