⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14155083 | 0.76 | — | — | |
| SCHEMBL24931066 | 0.75 | — | — | |
| SCHEMBL12341068 | 0.67 | — | — | |
| SCHEMBL9050500 | 0.60 | — | — | |
| SCHEMBL10052274 | 0.58 | — | — | |
| SCHEMBL10052273 | 0.58 | — | — | |
| SCHEMBL12806954 | 0.57 | — | — | |
| SCHEMBL3939112 | 0.56 | — | — | |
| SCHEMBL24950423 | 0.56 | — | — | |
| SCHEMBL17119542 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015153683-A1 | ANTI-FIBROTIC PYRIDINONES | INTERMUNE, INC. (US) | 2015-10-08 | — | — | WO | disclosed |
| US-20120157461-A1 | Indolyl-Substituted Pyrazino-Quinolines and Their Use for the Treatment of Cancer | ONKILL AB (SE) | 2012-06-21 | — | — | US | disclosed |