⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21346610 | 0.73 | — | — | |
| SCHEMBL805509 | 0.71 | — | — | |
| SCHEMBL284306 | 0.71 | — | — | |
| SCHEMBL384942 | 0.71 | — | — | |
| SCHEMBL18431917 | 0.69 | — | — | |
| SCHEMBL13149706 | 0.69 | — | — | |
| SCHEMBL21010321 | 0.68 | — | — | |
| SCHEMBL23773083 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL19049357 | 0.66 | — | — | |
| SCHEMBL8839223 | 0.63 | — | — |
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-1538183-B1 | THERMOPLASTIC FILM, THERMOPLASTIC RESIN COMPOSITION, AND PHYLLOSILICATE | TEIJIN LTD (JP) | 2007-10-31 | — | — | EP | disclosed |