⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL587426 | 0.85 | — | — | |
| SCHEMBL7131654 | 0.78 | — | — | |
| SCHEMBL16389783 | 0.76 | CYP3A4 (0.35) | — | |
| SCHEMBL15579165 | 0.76 | — | — | |
| SCHEMBL190614 | 0.76 | — | — | |
| SCHEMBL5172991 | 0.76 | — | — | |
| SCHEMBL1069120 | 0.74 | DNM1 (0.35) | — | |
| SCHEMBL27790377 | 0.73 | — | — | |
| SCHEMBL27926531 | 0.73 | — | — | |
| SCHEMBL10619916 | 0.72 | DNM1 (0.39) | — |
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-0276860-A2 | Method for preparing urea-functional organosilicon compounds | Toray Silicone Company, Ltd. (JP) | 1988-08-03 | — | — | EP | claimed |