⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7591511 | 1.00 | — | — | |
| SCHEMBL8617182 | 0.93 | — | — | |
| SCHEMBL8617184 | 0.93 | — | — | |
| SCHEMBL8397575 | 0.90 | — | — | |
| SCHEMBL7591521 | 0.88 | — | — | |
| SCHEMBL7972255 | 0.88 | — | — | |
| SCHEMBL7591329 | 0.88 | — | — | |
| SCHEMBL7973881 | 0.88 | — | — | |
| SCHEMBL7590351 | 0.85 | — | — | |
| SCHEMBL7976620 | 0.85 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6197973-B1 | HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2001-03-06 | — | — | US | disclosed |