⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5907994 | 0.76 | — | — | |
| SCHEMBL14518494 | 0.73 | — | — | |
| SCHEMBL871285 | 0.69 | — | — | |
| SCHEMBL13714367 | 0.67 | LMNA (0.30) | — | |
| SCHEMBL2468687 | 0.67 | — | — | |
| SCHEMBL2030789 | 0.67 | NFKB1 (0.30) | — | |
| SCHEMBL4446281 | 0.67 | — | — | |
| SCHEMBL15711452 | 0.66 | — | — | |
| SCHEMBL3789693 | 0.66 | — | — | |
| SCHEMBL6904964 | 0.66 | — | — |
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-2067797-A1 | SILICONE POLYMER, OCULAR LENSES, AND CONTACT LENS | Toray Industries, Inc. (JP) | 2009-06-10 | — | — | EP | disclosed |