⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1608647 | 0.88 | — | — | |
| SCHEMBL1608071 | 0.81 | — | — | |
| SCHEMBL1609083 | 0.81 | — | — | |
| SCHEMBL6064492 | 0.77 | SMN1; SMN2 (0.42) | — | |
| SCHEMBL28457272 | 0.74 | — | — | |
| SCHEMBL28448616 | 0.73 | CA1 (0.31) | — | |
| SCHEMBL16497587 | 0.72 | — | — | |
| SCHEMBL1608976 | 0.72 | — | — | |
| SCHEMBL10952977 | 0.72 | — | — | |
| SCHEMBL28453247 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5916973-A | Na, K and Li salts of siloxy compounds | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1999-06-29 | — | — | US | disclosed |
| EP-0794188-A1 | Na, k and Li salts of siloxy compounds | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1997-09-10 | — | — | EP | disclosed |