⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4635899 | 1.00 | — | — | |
| SCHEMBL3368513 | 0.85 | CAMK2A (0.46) | — | |
| SCHEMBL383865 | 0.78 | — | — | |
| SCHEMBL1645922 | 0.76 | — | — | |
| SCHEMBL5436286 | 0.76 | — | — | |
| SCHEMBL1556948 | 0.76 | — | — | |
| SCHEMBL5981768 | 0.74 | KDM4E (0.54) | — | |
| SCHEMBL9410888 | 0.74 | KDM4E (0.54) | — | |
| SCHEMBL9410883 | 0.74 | KDM4E (0.54) | — | |
| SCHEMBL4532099 | 0.74 | KDM4E (0.54) | — |
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-1569977-B1 | CURABLE COMPOSITIONS | SHERWIN WILLIAMS CO (US) | 2008-06-11 | — | — | EP | claimed |