⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11526116 | 0.94 | — | — | |
| SCHEMBL11526339 | 0.88 | — | — | |
| SCHEMBL11528358 | 0.88 | — | — | |
| SCHEMBL11173948 | 0.86 | — | — | |
| SCHEMBL14165377 | 0.82 | — | — | |
| SCHEMBL5550519 | 0.77 | — | — | |
| SCHEMBL23709271 | 0.76 | — | — | |
| SCHEMBL3456572 | 0.75 | — | — | |
| SCHEMBL11528520 | 0.74 | TSHR (0.34) | — | |
| SCHEMBL11525955 | 0.74 | TSHR (0.34) | — |
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-4177186-A | 4-SILOXY-DERIVATIVES OF STERICALLY HINDERED PIPERIDINES | CIBA-GEIGY CORPORATION (US) | 1979-12-04 | — | — | US | disclosed |