⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1068708 | 0.84 | — | — | |
| SCHEMBL16953801 | 0.76 | GABRA1 (0.32) | — | |
| SCHEMBL1063130 | 0.71 | — | — | |
| SCHEMBL28762502 | 0.69 | — | — | |
| SCHEMBL158133 | 0.68 | — | — | |
| SCHEMBL126173 | 0.67 | — | — | |
| SCHEMBL1064125 | 0.67 | — | — | |
| SCHEMBL27809468 | 0.67 | IDO1 (0.41) | — | |
| SCHEMBL1067736 | 0.67 | — | — | |
| SCHEMBL458164 | 0.64 | — | — |
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-4883789-A | Substituted phenyltrialkylsilane insecticides | FMC CORPORATION (US) | 1989-11-28 | — | — | US | disclosed |
| CN-87100628-A | The production method of silicoorganic compound and make the sterilant and the miticide of activeconstituents with it | — | 1988-03-02 | — | — | CN | disclosed |