⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9953235 | 0.78 | — | — | |
| SCHEMBL13965441 | 0.77 | — | — | |
| SCHEMBL14895055 | 0.74 | — | — | |
| SCHEMBL14895054 | 0.74 | — | — | |
| SCHEMBL15881754 | 0.72 | — | — | |
| SCHEMBL14539416 | 0.71 | — | — | |
| SCHEMBL29548049 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL15243734 | 0.71 | — | — | |
| SCHEMBL23940155 | 0.70 | — | — | |
| SCHEMBL14857080 | 0.70 | TSHR (0.38) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1068213-A4 | NOVEL AMINOORGANOFUNCTIONALSILOXANES | ARCHIMICA FLORIDA INC (US) | 2001-05-02 | — | — | EP | disclosed |
| EP-1068213-A1 | NOVEL AMINOORGANOFUNCTIONALSILOXANES | ARCHIMICA (FLORIDA), Inc. (US) | 2001-01-17 | — | — | EP | disclosed |
| WO-1999038872-A1 | NOVEL AMINOORGANOFUNCTIONALSILOXANES | ARCHIMICA (FLORIDA) INC. (US) | 1999-08-05 | — | — | WO | disclosed |