⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10454844 | 0.77 | — | — | |
| SCHEMBL10454843 | 0.77 | — | — | |
| SCHEMBL10258956 | 0.76 | — | — | |
| SCHEMBL1082005 | 0.76 | — | — | |
| SCHEMBL22193114 | 0.76 | — | — | |
| SCHEMBL23978222 | 0.76 | — | — | |
| SCHEMBL31300186 | 0.74 | — | — | |
| SCHEMBL22875507 | 0.74 | — | — | |
| SCHEMBL20762916 | 0.74 | — | — | |
| SCHEMBL29304569 | 0.72 | — | — |
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-8859563-B2 | Bicyclic pyrimidinones and uses thereof | AVEXA LIMITED (AU) | 2014-10-14 | — | — | US | disclosed |