⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9516453 | 1.00 | — | — | |
| SCHEMBL9518690 | 0.79 | THRB (0.36) | — | |
| SCHEMBL9516654 | 0.79 | THRB (0.36) | — | |
| SCHEMBL9800574 | 0.79 | THRB (0.36) | — | |
| SCHEMBL9514928 | 0.79 | THRB (0.36) | — | |
| SCHEMBL9515475 | 0.79 | THRB (0.36) | — | |
| Ethylamine SCHEMBL9516491 | 0.75 | — | — | |
| SCHEMBL6789695 | 0.72 | KDM4E (0.37) | — | |
| SCHEMBL9516401 | 0.71 | — | — | |
| SCHEMBL350769 | 0.69 | SUCNR1 (0.43) | — |
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-0341409-B1 | Platinum (II) complexes, their preparation and use as antitumour agents | BOEHRINGER MANNHEIM ITALIA (IT) | 1993-12-29 | — | — | EP | disclosed |