⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL123292 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL29024644 | 0.97 | — | — | |
| SCHEMBL229010 | 0.97 | LMNA (0.55) | — | |
| SCHEMBL6139861 | 0.97 | LMNA (0.55) | — | |
| SCHEMBL5001470 | 0.97 | — | — | |
| SCHEMBL225585 | 0.97 | — | — | |
| Iodide SCHEMBL22034593 | 0.94 | LMNA (0.52) | — | |
| SCHEMBL2475455 | 0.94 | — | — | |
| SCHEMBL24247404 | 0.87 | LMNA (0.40) | — | |
| SCHEMBL15870032 | 0.87 | LMNA (0.40) | — |
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-20080269193-A1 | Tetrahydroindole and Tetrahydroindazole Derivatives | SERENEX, INC. | 2008-10-30 | — | — | US | disclosed |