⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10856851 | 0.97 | — | — | |
| SCHEMBL30314 | 0.97 | — | — | |
| SCHEMBL1259464 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL28102020 | 0.93 | — | — | |
| SCHEMBL22260775 | 0.73 | CA5A (0.46) | — | |
| SCHEMBL28793209 | 0.70 | CA5A (0.42) | — | |
| SCHEMBL28879076 | 0.67 | — | — | |
| SCHEMBL1756936 | 0.62 | — | — | |
| SCHEMBL3061163 | 0.62 | — | — | |
| SCHEMBL12702449 | 0.62 | — | — |
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-1669093-B1 | Polyoxyalkylene copolymer blends as biomaterial for drug delivery and surface modification | TYCO HEALTHCARE (US) | 2010-02-24 | — | — | EP | claimed |