⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7797827 | 0.69 | — | — | |
| SCHEMBL1721038 | 0.67 | — | — | |
| SCHEMBL7616396 | 0.67 | — | — | |
| SCHEMBL5611694 | 0.66 | MAPT (0.34) | — | |
| SCHEMBL611093 | 0.66 | — | — | |
| SCHEMBL7831061 | 0.63 | — | — | |
| SCHEMBL1866638 | 0.61 | — | — | |
| SCHEMBL19100034 | 0.60 | — | — | |
| SCHEMBL12494175 | 0.59 | MAPT (0.36) | — | |
| SCHEMBL3655469 | 0.59 | — | — |
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-0095666-B1 | TETRAHYDRO-BENZO(E) ISOINDOLINES | ABBOTT LABORATORIES (US) | 1989-01-18 | — | — | EP | disclosed |