⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27860555 | 0.75 | KDM4E (0.37) | — | |
| SCHEMBL15497000 | 0.74 | — | — | |
| SCHEMBL13110414 | 0.72 | KDM4E (0.30) | — | |
| SCHEMBL13110405 | 0.72 | KDM4E (0.30) | — | |
| SCHEMBL13110569 | 0.72 | KDM4E (0.30) | — | |
| SCHEMBL13110419 | 0.72 | KDM4E (0.30) | — | |
| SCHEMBL13110408 | 0.72 | KDM4E (0.30) | — | |
| SCHEMBL14541 | 0.71 | — | — | |
| SCHEMBL13110415 | 0.70 | — | — | |
| SCHEMBL13110441 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1798258-B1 | Polymer composition | ROHM & HAAS (US) | 2011-03-16 | — | — | EP | claimed |