⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15765249 | 0.80 | — | — | |
| SCHEMBL13283576 | 0.80 | CPB2 (0.31) | — | |
| SCHEMBL15765288 | 0.80 | NMT2 (0.30) | — | |
| SCHEMBL17326053 | 0.79 | — | — | |
| SCHEMBL15765260 | 0.78 | CAPN1 (0.35) | — | |
| SCHEMBL17702020 | 0.76 | — | — | |
| SCHEMBL14074860 | 0.69 | — | — | |
| SCHEMBL15684673 | 0.68 | — | — | |
| SCHEMBL27429752 | 0.67 | FAP (0.34) | — | |
| SCHEMBL12841626 | 0.67 | DPP4 (0.37) | — |
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-2014084372-A1 | POLYPEPTIDE AND IMAGING METHOD | 国立大学法人京都大学 (JP) | 2014-06-05 | — | — | WO | disclosed |