⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL385578 | 0.82 | — | — | |
| SCHEMBL9077904 | 0.82 | — | — | |
| SCHEMBL385956 | 0.80 | OPRM1 (0.40) | — | |
| SCHEMBL1362975 | 0.78 | — | — | |
| SCHEMBL7104317 | 0.78 | TSHR (0.30) | — | |
| SCHEMBL386774 | 0.75 | — | — | |
| SCHEMBL18797447 | 0.75 | — | — | |
| SCHEMBL10712376 | 0.73 | CES1 (0.31) | — | |
| SCHEMBL1454750 | 0.73 | — | — | |
| SCHEMBL10623767 | 0.73 | EPHX1 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115052856-A | 3-alkoxybenzamide derivative and pest control agent | 组合化学工业株式会社 | 2022-09-13 | — | — | CN | disclosed |