⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12933034 | 0.79 | TDP1 (0.36) | — | |
| SCHEMBL10060786 | 0.75 | TDP1 (0.32) | — | |
| SCHEMBL12019197 | 0.71 | CA1 (0.31) | — | |
| SCHEMBL5519860 | 0.71 | PAOX (0.30) | — | |
| SCHEMBL14175635 | 0.69 | LMNA (0.37) | — | |
| SCHEMBL22944191 | 0.69 | PAOX (0.33) | — | |
| SCHEMBL23843067 | 0.68 | MCL1 (0.32) | — | |
| SCHEMBL13477979 | 0.67 | — | — | |
| SCHEMBL23991707 | 0.67 | — | — | |
| SCHEMBL23736346 | 0.66 | LMNA (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021015234-A1 | CHIMERIC MOLECULE, PHARMACEUTICAL COMPOSITION, METHOD FOR CLEAVING TARGET NUCLEIC ACID, AND KIT FOR TARGET NUCLEIC ACID CLEAVAGE OR DIAGNOSIS | 国立大学法人東北大学 | 2021-01-28 | — | — | WO | disclosed |