⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL339306 | 0.85 | TRPV1 (0.33) | — | |
| SCHEMBL339307 | 0.85 | TRPV1 (0.33) | — | |
| SCHEMBL341061 | 0.84 | TRPV1 (0.33) | — | |
| SCHEMBL341062 | 0.84 | TRPV1 (0.33) | — | |
| SCHEMBL339427 | 0.78 | MALT1 (0.35) | — | |
| SCHEMBL45070 | 0.78 | MALT1 (0.35) | — | |
| SCHEMBL340885 | 0.77 | MALT1 (0.35) | — | |
| SCHEMBL45427 | 0.77 | MALT1 (0.35) | — | |
| SCHEMBL45475 | 0.73 | TRPA1 (0.35) | — | |
| SCHEMBL44772 | 0.72 | TRPA1 (0.35) | — |
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-8791139-B2 | Anthranilic diamide derivatives | BAYER CROPSCIENCE AG (DE) | 2014-07-29 | — | — | US | disclosed |
| US-20120015980-A1 | ANTHRANILIC DIAMIDE DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2012-01-19 | — | — | US | disclosed |