⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21913465 | 0.67 | — | — | |
| SCHEMBL6678722 | 0.64 | — | — | |
| SCHEMBL18755026 | 0.64 | — | — | |
| SCHEMBL24444770 | 0.62 | — | — | |
| SCHEMBL12334107 | 0.62 | — | — | |
| SCHEMBL23097003 | 0.61 | — | — | |
| SCHEMBL21965974 | 0.60 | EGFR (0.32) | — | |
| SCHEMBL24102955 | 0.59 | — | — | |
| SCHEMBL21912973 | 0.58 | — | — | |
| SCHEMBL22619366 | 0.57 | PDGFRB (0.38) | — |
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-3885344-A2 | PYRIMIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF | InventisBio Co., Ltd. (CN) | 2021-09-29 | — | — | EP | disclosed |