⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7164477 | 0.77 | — | — | |
| SCHEMBL11121532 | 0.75 | — | — | |
| SCHEMBL4711642 | 0.75 | — | — | |
| SCHEMBL4454381 | 0.71 | — | — | |
| SCHEMBL14363079 | 0.70 | — | — | |
| SCHEMBL22521369 | 0.70 | SLC6A2 (0.33) | — | |
| SCHEMBL11068073 | 0.70 | — | — | |
| SCHEMBL20733705 | 0.70 | — | — | |
| SCHEMBL21962268 | 0.70 | — | — | |
| SCHEMBL29259237 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4458079-A | BACTERICIDES, FUNGICIDES | BRISTOL-MYERS COMPANY (US) | 1984-07-03 | — | — | US | disclosed |
| US-4315023-A | FOR USE AS FUNGICIDES AND BACTERICIDES | WESTWOOD PHARMACEUTICALS, INC. (US) | 1982-02-09 | — | — | US | disclosed |