⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11156845 | 0.82 | — | — | |
| SCHEMBL27196835 | 0.79 | KDM4E (0.31) | — | |
| SCHEMBL247464 | 0.74 | — | — | |
| SCHEMBL2691271 | 0.72 | — | — | |
| SCHEMBL264762 | 0.72 | — | — | |
| SCHEMBL3887589 | 0.72 | — | — | |
| SCHEMBL9273813 | 0.71 | — | — | |
| SCHEMBL8655362 | 0.71 | — | — | |
| SCHEMBL5702321 | 0.70 | — | — | |
| SCHEMBL967682 | 0.70 | — | — |
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-4368476-A | TREATED WITH A FLUORINE CONTAINING COMPOUND | CANON KABUSHIKI KAISHA (JP) | 1983-01-11 | — | — | US | claimed |