⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13862973 | 0.90 | — | — | |
| SCHEMBL12700284 | 0.89 | — | — | |
| SCHEMBL13623868 | 0.84 | — | — | |
| SCHEMBL13862971 | 0.82 | — | — | |
| SCHEMBL13623422 | 0.82 | — | — | |
| SCHEMBL13623875 | 0.81 | — | — | |
| SCHEMBL12187096 | 0.80 | — | — | |
| SCHEMBL13511477 | 0.80 | — | — | |
| SCHEMBL12331531 | 0.80 | — | — | |
| SCHEMBL13303983 | 0.79 | — | — |
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-2010094378-A1 | ORGANIC ELECTRONIC DEVICE | MERCK PATENT GMBH (DE) | 2010-08-26 | — | — | WO | disclosed |