⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9005197 | 0.82 | — | — | |
| SCHEMBL8056547 | 0.79 | — | — | |
| SCHEMBL8056550 | 0.79 | — | — | |
| SCHEMBL3416046 | 0.79 | — | — | |
| SCHEMBL11809967 | 0.77 | TSHR (0.32) | — | |
| SCHEMBL23122 | 0.77 | TSHR (0.37) | — | |
| SCHEMBL11357736 | 0.76 | — | — | |
| SCHEMBL8776602 | 0.74 | — | — | |
| SCHEMBL10400853 | 0.74 | TSHR (0.30) | — | |
| SCHEMBL2590300 | 0.73 | TSHR (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0809646-A1 | A METHOD FOR MANUFACTURING ORGANOSILANES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1997-12-03 | — | — | EP | disclosed |
| WO-1996025419-A1 | A METHOD FOR MANUFACTURING ORGANOSILANES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-08-22 | — | — | WO | disclosed |