⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9253701 | 0.80 | — | — | |
| SCHEMBL25661094 | 0.79 | — | — | |
| SCHEMBL986099 | 0.79 | — | — | |
| SCHEMBL5319350 | 0.76 | HIF1A (0.35) | — | |
| SCHEMBL11654686 | 0.73 | HPGD (0.38) | — | |
| SCHEMBL18269646 | 0.73 | HPGD (0.38) | — | |
| SCHEMBL7125786 | 0.72 | — | — | |
| SCHEMBL9050152 | 0.72 | — | — | |
| SCHEMBL2683423 | 0.72 | — | — | |
| SCHEMBL28291510 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101684074-A | Unsymmetrical hydrogen transfer synthetic method of (R)-salmeterol | UNIV SUN YAT SEN | 2010-03-31 | — | — | CN | claimed |
| CN-101684074-A | Unsymmetrical hydrogen transfer synthetic method of (R)-salmeterol | UNIV SUN YAT SEN | 2010-03-31 | — | — | CN | disclosed |