⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL79757 | 0.85 | — | — | |
| SCHEMBL22436762 | 0.83 | — | — | |
| SCHEMBL159337 | 0.83 | — | — | |
| SCHEMBL4080215 | 0.80 | — | — | |
| SCHEMBL1502666 | 0.80 | — | — | |
| SCHEMBL23856129 | 0.80 | — | — | |
| SCHEMBL7864101 | 0.79 | — | — | |
| SCHEMBL17396296 | 0.77 | — | — | |
| SCHEMBL1772847 | 0.77 | — | — | |
| SCHEMBL1109684 | 0.77 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230203275-A1 | CURABLE ORGANOPOLYSILOXANE COMPOSITIONS | WACKER CHEMIE AG (DE) | 2023-06-29 | — | — | US | disclosed |
| US-20210238416-A1 | CURABLE ORGANOPOLYSILOXANE COMPOSITIONS | WACKER CHEMIE AG (DE) | 2021-08-05 | — | — | US | disclosed |