⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29911230 | 1.00 | — | — | |
| SCHEMBL23405284 | 1.00 | — | — | |
| SCHEMBL23405183 | 0.90 | HRH2 (0.30) | — | |
| SCHEMBL23429861 | 0.90 | HRH2 (0.30) | — | |
| SCHEMBL23429773 | 0.88 | PI4KA (0.33) | — | |
| SCHEMBL23405239 | 0.88 | PI4KA (0.33) | — | |
| SCHEMBL23429787 | 0.82 | PRMT5 (0.34) | — | |
| SCHEMBL22521404 | 0.82 | PRMT5 (0.34) | — | |
| SCHEMBL21061526 | 0.82 | PRMT5 (0.34) | — | |
| SCHEMBL29565934 | 0.82 | PRMT5 (0.34) | — |
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-20210163486-A1 | SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS | LUPIN LIMITED (IN) | 2021-06-03 | — | — | US | disclosed |