⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7175957 | 0.78 | — | — | |
| SCHEMBL15251670 | 0.78 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL107772 | 0.77 | — | — | |
| SCHEMBL7174781 | 0.76 | — | — | |
| SCHEMBL106479 | 0.76 | — | — | |
| SCHEMBL107685 | 0.73 | — | — | |
| SCHEMBL306894 | 0.72 | — | — | |
| SCHEMBL10399368 | 0.71 | — | — | |
| SCHEMBL9342158 | 0.71 | — | — | |
| SCHEMBL5002878 | 0.71 | ALDH1A1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0217334-B1 | RADIATION-CURABLE ORGANOPOLYSILOXANE COATING COMPOSITION | DOW CORNING CORPORATION (US) | 1991-07-31 | — | — | EP | disclosed |
| US-4596720-A | Radiation-curable organopolysiloxane coating composition | DOW CORNING CORPORATION (US) | 1986-06-24 | — | — | US | disclosed |