⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8060023 | 1.00 | — | — | |
| SCHEMBL8061047 | 0.91 | HTT (0.30) | — | |
| SCHEMBL8061045 | 0.91 | HTT (0.30) | — | |
| SCHEMBL8336348 | 0.89 | L3MBTL1 (0.32) | — | |
| SCHEMBL7081178 | 0.89 | GCGR (0.34) | — | |
| SCHEMBL7081180 | 0.89 | GCGR (0.34) | — | |
| SCHEMBL8336346 | 0.89 | L3MBTL1 (0.32) | — | |
| SCHEMBL8061119 | 0.88 | — | — | |
| SCHEMBL8061121 | 0.88 | — | — | |
| SCHEMBL8059006 | 0.84 | KDR (0.32) | — |
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-0816331-B1 | Fungicidally active n-acetonylbenzamide compounds | ROHM & HAAS (US) | 2000-05-24 | — | — | EP | disclosed |
| US-5929098-A | Fungicidically active N-acetonylbenzamide compounds | ROHM AND HAAS COMPANY (US) | 1999-07-27 | — | — | US | disclosed |