⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9405105 | 0.79 | — | — | |
| SCHEMBL6365020 | 0.78 | — | — | |
| SCHEMBL4984798 | 0.77 | — | — | |
| SCHEMBL1122688 | 0.77 | — | — | |
| SCHEMBL55040 | 0.77 | — | — | |
| SCHEMBL6266389 | 0.77 | — | — | |
| SCHEMBL3252538 | 0.77 | — | — | |
| SCHEMBL3980860 | 0.77 | — | — | |
| SCHEMBL1456355 | 0.77 | — | — | |
| SCHEMBL7353472 | 0.77 | — | — |
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-6342503-B1 | ANTIDEPRESSANTS, EATING DISORDERS | DUPONT PHARMACEUTICALS COMPANY | 2002-01-29 | — | — | US | disclosed |