⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9948422 | 0.91 | — | — | |
| SCHEMBL9948424 | 0.91 | — | — | |
| SCHEMBL9948426 | 0.84 | — | — | |
| SCHEMBL9948035 | 0.83 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL9948036 | 0.83 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL9948207 | 0.80 | DPP4 (0.34) | — | |
| SCHEMBL9947892 | 0.79 | APLNR (0.36) | — | |
| SCHEMBL9948184 | 0.79 | — | — | |
| SCHEMBL9947890 | 0.79 | APLNR (0.36) | — | |
| SCHEMBL9948189 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2687523-A1 | NOVEL PHENYLPYRIDINE DERIVATIVE AND DRUG CONTAINING SAME | Kowa Company Ltd. (JP) | 2014-01-22 | — | — | EP | disclosed |