⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6046320 | 0.74 | — | — | |
| SCHEMBL1224562 | 0.73 | — | — | |
| SCHEMBL28239318 | 0.71 | — | — | |
| SCHEMBL9979376 | 0.69 | — | — | |
| SCHEMBL434615 | 0.69 | — | — | |
| SCHEMBL7026371 | 0.69 | — | — | |
| SCHEMBL11764489 | 0.67 | — | — | |
| SCHEMBL8395270 | 0.67 | — | — | |
| SCHEMBL5499984 | 0.67 | — | — | |
| SCHEMBL29640853 | 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 |
|---|---|---|---|---|---|---|---|
| EP-0269447-A2 | Structures surface modified with bidentate silanes | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1988-06-01 | — | — | EP | disclosed |