⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6140728 | 0.82 | — | — | |
| SCHEMBL12878731 | 0.78 | — | — | |
| SCHEMBL9064718 | 0.77 | — | — | |
| SCHEMBL1635149 | 0.76 | — | — | |
| SCHEMBL6842421 | 0.74 | — | — | |
| SCHEMBL662596 | 0.73 | — | — | |
| SCHEMBL12814535 | 0.73 | ALDH1A1 (0.34) | — | |
| SCHEMBL9128125 | 0.71 | — | — | |
| SCHEMBL6298767 | 0.70 | — | — | |
| SCHEMBL359200 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0091291-B1 | ROOM TEMPERATURE STABLE, HEAT ACTIVATED ORGANOPOLYSILOXANE COMPOSITIONS | Toray Silicone Company Limited (JP) | 1987-05-13 | — | — | EP | disclosed |
| US-4465818-A | Room temperature stable, heat activated organopolysiloxane compositions | TORAY SILICONE COMPANY, LTD. (JP) | 1984-08-14 | — | — | US | disclosed |
| US-4439630-A | ENCAPSULATION AND INSULATION | DOW CORNING CORPORATION (US) | 1984-03-27 | — | — | US | disclosed |
| EP-0091291-A2 | Room temperature stable, heat activated organopolysiloxane compositions | Toray Silicone Company Limited (JP) | 1983-10-12 | — | — | EP | disclosed |
| EP-0080704-A1 | Silicone compositions for buried electrical splice closures | DOW CORNING CORPORATION (US) | 1983-06-08 | — | — | EP | disclosed |