⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4119855 | 1.00 | — | — | |
| SCHEMBL27553905 | 0.80 | — | — | |
| SCHEMBL6671473 | 0.80 | — | — | |
| SCHEMBL6671483 | 0.80 | — | — | |
| SCHEMBL585046 | 0.78 | — | — | |
| SCHEMBL818785 | 0.72 | — | — | |
| SCHEMBL1035964 | 0.72 | — | — | |
| SCHEMBL14456626 | 0.72 | — | — | |
| SCHEMBL1035965 | 0.72 | — | — | |
| SCHEMBL818784 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090221596-A1 | Substtituted aryl oximes | BAYER CROPSCIENCE AG (DE) | 2009-09-03 | — | — | US | disclosed |
| WO-1988005264-A1 | TRIAZOLIN-5-ONE HERBICIDES | FMC CORPORATION (US) | 1988-07-28 | — | — | WO | disclosed |