⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19988107 | 0.73 | — | — | |
| SCHEMBL18630376 | 0.71 | — | — | |
| SCHEMBL21665554 | 0.67 | — | — | |
| SCHEMBL16199488 | 0.65 | — | — | |
| SCHEMBL9306051 | 0.62 | HSP90AA1 (0.36) | — | |
| SCHEMBL20628330 | 0.60 | — | — | |
| SCHEMBL290445 | 0.59 | — | — | |
| SCHEMBL6204683 | 0.59 | — | — | |
| SCHEMBL7365607 | 0.59 | — | — | |
| SCHEMBL30129407 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0853621-A1 | NOVEL SUBSTITUTED AZACYCLIC OR AZABICYCLIC COMPOUNDS | NOVO NORDISK A/S (DK) | 1998-07-22 | — | — | EP | disclosed |
| WO-1997011072-A1 | NOVEL SUBSTITUTED AZACYCLIC OR AZABICYCLIC COMPOUNDS | NOVO NORDISK A/S (DK) | 1997-03-27 | — | — | WO | disclosed |