⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19042347 | 0.82 | POLB (0.39) | — | |
| Hydrochloric Acid SCHEMBL2750120 | 0.72 | SOD3 (0.34) | — | |
| SCHEMBL18806203 | 0.71 | AADAT (0.36) | — | |
| SCHEMBL18806097 | 0.69 | PDK2 (0.38) | — | |
| SCHEMBL30970615 | 0.69 | AADAT (0.33) | — | |
| SCHEMBL31652215 | 0.69 | HTR2C (0.34) | — | |
| SCHEMBL15203113 | 0.67 | — | — | |
| SCHEMBL17214083 | 0.67 | AADAT (0.37) | — | |
| SCHEMBL12478204 | 0.67 | PTGS2 (0.39) | — | |
| SCHEMBL12182132 | 0.67 | POLB (0.37) | — |
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-3172214-B1 | 2-AMINO-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE DERIVATIVES AS CDK INHIBITORS AND USES THEREOF | SUNSHINE LAKE PHARMA CO LTD (CN) | 2020-05-13 | — | — | EP | disclosed |