⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4122966 | 0.85 | — | — | |
| SCHEMBL482962 | 0.82 | — | — | |
| SCHEMBL21462814 | 0.81 | — | — | |
| SCHEMBL26651090 | 0.81 | — | — | |
| SCHEMBL8468374 | 0.81 | — | — | |
| SCHEMBL332238 | 0.80 | — | — | |
| SCHEMBL1886435 | 0.79 | MAPT (0.30) | — | |
| SCHEMBL10841333 | 0.79 | MAPT (0.30) | — | |
| SCHEMBL8859363 | 0.77 | CA2 (0.38) | — | |
| SCHEMBL18736745 | 0.77 | TRPM8 (0.31) | — |
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-0408558-A4 | HYDROPHILIC POLYURETHANES PREPARED FROM MIXED OXYALKYLENE GLYCOLS | — | 1991-03-20 | — | — | EP | disclosed |
| EP-0408558-A1 | HYDROPHILIC POLYURETHANES PREPARED FROM MIXED OXYALKYLENE GLYCOLS | TYNDALE PLAINS-HUNTER, LTD. (US) | 1991-01-23 | — | — | EP | disclosed |
| WO-1989008672-A1 | HYDROPHILIC POLYURETHANES PREPARED FROM MIXED OXYALKYLENE GLYCOLS | TYNDALE PLAINS-HUNTER, LTD. (US) | 1989-09-21 | — | — | WO | disclosed |