⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21363432 | 0.73 | TRPA1 (0.33) | — | |
| SCHEMBL21363445 | 0.64 | TRPA1 (0.33) | — | |
| SCHEMBL21363468 | 0.63 | — | — | |
| SCHEMBL21363436 | 0.60 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL21363694 | 0.60 | TRPA1 (0.33) | — | |
| SCHEMBL22477646 | 0.59 | TRPA1 (0.40) | — | |
| SCHEMBL26155644 | 0.59 | — | — | |
| SCHEMBL20203369 | 0.57 | BRD9 (0.35) | — | |
| SCHEMBL9910957 | 0.56 | TNKS (0.37) | — | |
| SCHEMBL21363375 | 0.56 | 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-10710994-B2 | Oxadiazole transient receptor potential channel inhibitors | GENENTECH, INC. (US) | 2020-07-14 | — | — | US | disclosed |
| US-20190284179-A1 | OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS | GENENTECH, INC. (US) | 2019-09-19 | — | — | US | disclosed |