⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18697860 | 0.78 | — | — | |
| SCHEMBL17662627 | 0.74 | — | — | |
| SCHEMBL22334423 | 0.74 | — | — | |
| SCHEMBL17662658 | 0.71 | ATM (0.31) | — | |
| SCHEMBL15375178 | 0.70 | — | — | |
| SCHEMBL7931450 | 0.70 | — | — | |
| SCHEMBL24454860 | 0.68 | DAO (0.33) | — | |
| SCHEMBL11960356 | 0.68 | PDE3B (0.31) | — | |
| SCHEMBL25888755 | 0.68 | — | — | |
| SCHEMBL11959963 | 0.68 | — | — |
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-2481732-A1 | Condensed ring compound and use thereof | Ono Pharmaceutical Co., Ltd. (JP) | 2012-08-01 | — | — | EP | disclosed |