⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20282979 | 0.83 | — | — | |
| SCHEMBL22909191 | 0.83 | — | — | |
| SCHEMBL19524893 | 0.83 | — | — | |
| SCHEMBL19891854 | 0.78 | — | — | |
| SCHEMBL13195134 | 0.73 | — | — | |
| SCHEMBL25841107 | 0.73 | — | — | |
| SCHEMBL13570 | 0.73 | — | — | |
| SCHEMBL13195863 | 0.73 | — | — | |
| SCHEMBL7721455 | 0.69 | — | — | |
| SCHEMBL9340047 | 0.64 | — | — |
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-20230227484-A1 | PYRIMIDINE COMPOUND AS AXL INHIBITOR | NANJING CHIA TAI TIANQING PHARMACEUTICAL CO., LTD. (CN) | 2023-07-20 | — | — | US | disclosed |