⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2927541 | 0.72 | — | — | |
| SCHEMBL10325788 | 0.70 | — | — | |
| SCHEMBL21792155 | 0.70 | — | — | |
| Cytosine SCHEMBL308339 | 0.70 | — | — | |
| SCHEMBL4795553 | 0.70 | — | — | |
| Cytosine SCHEMBL29787229 | 0.70 | POLB (0.42) | — | |
| SCHEMBL30315297 | 0.70 | — | — | |
| SCHEMBL29933891 | 0.70 | HCAR2 (0.48) | — | |
| SCHEMBL916879 | 0.67 | POLB (0.44) | — | |
| SCHEMBL14174687 | 0.65 | — | — |
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-3983409-A1 | PYRIDYL OR PYRIMIDYL MTOR KINASE INHIBITORS | GlaxoSmithKline Intellectual Property Development Limited (GB) | 2022-04-20 | — | — | EP | disclosed |