⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26605944 | 1.00 | — | — | |
| SCHEMBL26544857 | 1.00 | — | — | |
| SCHEMBL25237525 | 1.00 | — | — | |
| SCHEMBL8431992 | 0.82 | — | — | |
| SCHEMBL29886820 | 0.82 | — | — | |
| SCHEMBL1931724 | 0.82 | — | — | |
| SCHEMBL8431988 | 0.82 | — | — | |
| SCHEMBL23707362 | 0.82 | — | — | |
| SCHEMBL1931727 | 0.82 | — | — | |
| SCHEMBL14049617 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116745292-A | Substituted pyridotriazine compounds and uses thereof | 吉利德科学公司 | 2023-09-12 | — | — | CN | disclosed |