⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL256777 | 0.65 | — | — | |
| SCHEMBL256058 | 0.61 | — | — | |
| SCHEMBL256774 | 0.53 | — | — | |
| Tetramethylene Sulfoxide SCHEMBL27830 | 0.50 | — | — | |
| Oxirane SCHEMBL11496661 | 0.45 | — | — | |
| Oxirane SCHEMBL1740654 | 0.45 | — | — | |
| Oxirane SCHEMBL973217 | 0.42 | — | — | |
| Oxirane SCHEMBL11492072 | 0.42 | — | — | |
| Oxirane SCHEMBL654963 | 0.42 | — | — | |
| Oxirane SCHEMBL3587 | 0.42 | — | — |
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-1565442-B1 | PYRIDINE DERIVATIVES AS CB2 RECEPTOR MODULATORS | GLAXO GROUP LTD (GB) | 2007-11-14 | — | — | EP | claimed |