⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22787280 | 0.83 | — | — | |
| SCHEMBL4112644 | 0.78 | — | — | |
| SCHEMBL2993973 | 0.78 | — | — | |
| SCHEMBL12599604 | 0.77 | LMNA (0.35) | — | |
| SCHEMBL14981125 | 0.72 | CFD (0.31) | — | |
| SCHEMBL172114 | 0.70 | ACHE (0.36) | — | |
| Bromide SCHEMBL2647555 | 0.69 | — | — | |
| SCHEMBL29620265 | 0.66 | ACHE (0.42) | — | |
| SCHEMBL384037 | 0.66 | ACHE (0.42) | — | |
| SCHEMBL4549537 | 0.66 | ACHE (0.39) | — |
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-0675876-A1 | ARALKYLOXY- AND ARALKYLTHIO ALKOXIMINO DERIVATIVES AND THEIR USE AS FUNGICIDES. | ZENECA LTD (GB) | 1995-10-11 | — | — | EP | disclosed |
| WO-1994014761-A1 | ARALKYLOXY- AND ARALKYLTHIO ALKOXIMINO DERIVATIVES AND THEIR USE AS FUNGICIDES | ZENECA LIMITED (GB) | 1994-07-07 | — | — | WO | disclosed |