⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL472156 | 0.77 | — | — | |
| SCHEMBL5833597 | 0.75 | — | — | |
| SCHEMBL5834439 | 0.75 | — | — | |
| Ethane SCHEMBL5834292 | 0.73 | — | — | |
| SCHEMBL28378591 | 0.73 | — | — | |
| Ethylene SCHEMBL5833395 | 0.71 | — | — | |
| SCHEMBL5833987 | 0.71 | — | — | |
| SCHEMBL5833900 | 0.71 | ALDH1A1 (0.33) | — | |
| SCHEMBL4117100 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL1070260 | 0.69 | — | — |
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-0801664-A4 | AQUEOUS SILYLATED POLYMER CURABLE COMPOSITIONS | OSI SPECIALTIES INC (US) | 1999-10-20 | — | — | EP | disclosed |
| EP-0801664-A1 | AQUEOUS SILYLATED POLYMER CURABLE COMPOSITIONS | OSi SPECIALTIES, INC. (US) | 1997-10-22 | — | — | EP | disclosed |
| WO-1997015624-A1 | AQUEOUS SILYLATED POLYMER CURABLE COMPOSITIONS | OSI SPECIALTIES, INC. (US) | 1997-05-01 | — | — | WO | disclosed |