⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15359623 | 0.46 | — | — | |
| SCHEMBL22517161 | 0.45 | — | — | |
| SCHEMBL22517160 | 0.45 | — | — | |
| SCHEMBL483728 | 0.36 | — | — | |
| Ligustrazine SCHEMBL77624 | 0.34 | LMNA (0.41) | — | |
| SCHEMBL24425415 | 0.33 | — | — | |
| SCHEMBL1160833 | 0.33 | — | — | |
| SCHEMBL3320271 | 0.33 | — | — | |
| SCHEMBL24425413 | 0.33 | — | — | |
| SCHEMBL858269 | 0.33 | — | — |
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-20160263090-A1 | ANTI-FIBROTIC PYRIDINONES | GENENTECH, INC. | 2016-09-15 | — | — | US | disclosed |