⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15915168 | 0.72 | — | — | |
| SCHEMBL15915876 | 0.72 | — | — | |
| SCHEMBL16225031 | 0.70 | — | — | |
| SCHEMBL15909952 | 0.70 | — | — | |
| SCHEMBL1315992 | 0.67 | — | — | |
| SCHEMBL2958647 | 0.67 | — | — | |
| SCHEMBL2950200 | 0.67 | — | — | |
| SCHEMBL15915463 | 0.66 | TSHR (0.32) | — | |
| SCHEMBL1315717 | 0.64 | TSHR (0.30) | — | |
| SCHEMBL7518719 | 0.63 | TSHR (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108473684-B | Process for producing siloxane polymer | 东丽精细化工株式会社 | 2023-05-12 | — | — | CN | disclosed |