⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL111375 | 0.94 | — | — | |
| Phosphine SCHEMBL11421364 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL11048819 | 0.89 | — | — | |
| SCHEMBL9812478 | 0.89 | — | — | |
| Methyl Alcohol SCHEMBL6922737 | 0.80 | — | — | |
| SCHEMBL223825 | 0.74 | — | — | |
| SCHEMBL103174 | 0.74 | — | — | |
| SCHEMBL17318160 | 0.74 | — | — | |
| SCHEMBL1062616 | 0.74 | — | — | |
| SCHEMBL2520528 | 0.70 | MAPT (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-112334130-A | RSV replication inhibitors and uses thereof | 佐治亚州立大学研究基金会公司 | 2021-02-05 | — | — | CN | disclosed |