⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14446381 | 0.83 | POLB (0.33) | — | |
| SCHEMBL16068371 | 0.80 | — | — | |
| SCHEMBL14220159 | 0.80 | — | — | |
| SCHEMBL14730573 | 0.80 | — | — | |
| SCHEMBL12363321 | 0.80 | — | — | |
| SCHEMBL13976395 | 0.79 | POLB (0.34) | — | |
| SCHEMBL13640049 | 0.77 | POLB (0.35) | — | |
| SCHEMBL13980581 | 0.76 | — | — | |
| SCHEMBL13149374 | 0.76 | — | — | |
| SCHEMBL14724756 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3653574-B1 | SURFACE-MODIFIED INORGANIC NITRIDE, COMPOSITION, THERMALLY CONDUCTIVE MATERIAL, DEVICE PROVIDED WITH THERMALLY CONDUCTIVE LAYER | FUJIFILM CORP (JP) | 2021-01-06 | — | — | EP | disclosed |
| EP-2562162-B1 | N-CYANO-4-AMINO-5-FLUORO-PYRIMIDINE DERIVATIVES AS FUNGICIDES | DOW AGROSCIENCES LLC (US) | 2015-08-19 | — | — | EP | disclosed |