⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7200961 | 0.74 | — | — | |
| SCHEMBL2104237 | 0.72 | KDM4E (0.31) | — | |
| SCHEMBL224515 | 0.70 | KDM4E (0.30) | — | |
| SCHEMBL7258032 | 0.70 | CA12 (0.32) | — | |
| SCHEMBL16324525 | 0.68 | HTT (0.35) | — | |
| SCHEMBL22075884 | 0.68 | TSHR (0.35) | — | |
| SCHEMBL2103475 | 0.68 | TSHR (0.33) | — | |
| SCHEMBL7972375 | 0.66 | KDM4E (0.33) | — | |
| SCHEMBL692875 | 0.63 | — | — | |
| SCHEMBL4608700 | 0.62 | CXCR2 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5359051-A | Compounds useful in the synthesis of nucleic acids capable of cleaning RNA | ISIS PHARMACEUTICALS (US) | 1994-10-25 | — | — | US | disclosed |