⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18032669 | 0.58 | — | — | |
| SCHEMBL60511 | 0.56 | — | — | |
| SCHEMBL13079035 | 0.55 | — | — | |
| SCHEMBL14994538 | 0.55 | — | — | |
| SCHEMBL8759887 | 0.54 | — | — | |
| SCHEMBL76519 | 0.53 | — | — | |
| SCHEMBL16026307 | 0.53 | GPR3 (0.31) | — | |
| SCHEMBL1752066 | 0.51 | AHR (0.48) | — | |
| SCHEMBL4447177 | 0.50 | — | — | |
| SCHEMBL4449729 | 0.50 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9643952-B2 | Pyridone compound | KYOWA HAKKO KIRIN CO., LTD. (JP) | 2017-05-09 | — | — | US | disclosed |
| US-20150315172-A1 | PYRIDONE COMPOUND | KYOWA KIRIN CO., LTD. (JP) | 2015-11-05 | — | — | US | disclosed |