⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5640982 | 0.83 | — | — | |
| SCHEMBL7946914 | 0.74 | — | — | |
| SCHEMBL3369579 | 0.71 | — | — | |
| SCHEMBL18235143 | 0.70 | GSK3A (0.36) | — | |
| SCHEMBL7308512 | 0.67 | MEN1 (0.33) | — | |
| SCHEMBL8888317 | 0.67 | — | — | |
| SCHEMBL12395175 | 0.65 | — | — | |
| SCHEMBL7782428 | 0.65 | — | — | |
| SCHEMBL8545706 | 0.65 | GMNN (0.38) | — | |
| SCHEMBL10696994 | 0.65 | — | — |
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-1664153-A1 | MOLECULAR WEIGHT INCREASE AND MODIFICATION OF POLYCONDENSATES | Ciba SC Holding AG (CH) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005030834-A1 | MOLECULAR WEIGHT INCREASE AND MODIFICATION OF POLYCONDENSATES | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2005-04-07 | — | — | WO | disclosed |