⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18884450 | 0.83 | — | — | |
| SCHEMBL18884453 | 0.79 | — | — | |
| SCHEMBL18884456 | 0.76 | — | — | |
| SCHEMBL18884454 | 0.74 | — | — | |
| SCHEMBL18884458 | 0.74 | — | — | |
| SCHEMBL18884460 | 0.74 | — | — | |
| SCHEMBL19170273 | 0.72 | — | — | |
| SCHEMBL19170184 | 0.72 | — | — | |
| SCHEMBL19170170 | 0.69 | — | — | |
| SCHEMBL19170337 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20170145039-A1 | FLUORINE-CONTAINING SILANE COMPOUND | MITSUBISHI MATERIALS CORPORATION (JP) | 2017-05-25 | — | — | US | disclosed |