⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27287211 | 0.75 | — | — | |
| SCHEMBL23132001 | 0.75 | — | — | |
| SCHEMBL7821165 | 0.72 | — | — | |
| SCHEMBL2032709 | 0.72 | — | — | |
| SCHEMBL27430864 | 0.71 | — | — | |
| SCHEMBL27573520 | 0.70 | — | — | |
| SCHEMBL25060329 | 0.70 | — | — | |
| SCHEMBL19350616 | 0.69 | TSHR (0.30) | — | |
| SCHEMBL5621935 | 0.69 | — | — | |
| SCHEMBL26373959 | 0.69 | TSHR (0.30) | — |
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-2021159015-A1 | NAMPT MODULATORS | CYTOKINETICS, INC. (US) | 2021-08-12 | — | — | WO | disclosed |