⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21441594 | 0.97 | KDM4E (0.30) | — | |
| SCHEMBL21133516 | 0.97 | KDM4E (0.30) | — | |
| SCHEMBL21133449 | 0.91 | — | — | |
| SCHEMBL19263677 | 0.91 | — | — | |
| SCHEMBL21133701 | 0.91 | ALDH1A1 (0.33) | — | |
| SCHEMBL21733114 | 0.89 | — | — | |
| SCHEMBL15431760 | 0.83 | ALDH1A1 (0.34) | — | |
| SCHEMBL21133459 | 0.81 | — | — | |
| SCHEMBL21733107 | 0.79 | — | — | |
| SCHEMBL21133704 | 0.79 | — | — |
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-3549963-A2 | HIGH MOLECULAR WEIGHT ZWITTERION-CONTAINING POLYMERS | Kodiak Sciences Inc. (US) | 2019-10-09 | — | — | EP | disclosed |