⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27492 | 0.88 | — | — | |
| Ammonia Solution, Strong SCHEMBL7288994 | 0.87 | — | — | |
| SCHEMBL11470279 | 0.87 | — | — | |
| SCHEMBL27630337 | 0.83 | PRMT3 (0.44) | — | |
| SCHEMBL12125006 | 0.83 | — | — | |
| SCHEMBL5530480 | 0.83 | — | — | |
| SCHEMBL2997593 | 0.83 | — | — | |
| SCHEMBL11498988 | 0.82 | — | — | |
| SCHEMBL7254828 | 0.82 | SLC18A3 (0.43) | — | |
| SCHEMBL5888793 | 0.82 | OPRD1 (0.55) | — |
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-113366107-A | Antibacterial antisense agents | 佩达尼斯治疗有限公司 | 2021-09-07 | — | — | CN | disclosed |