⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24892821 | 0.80 | TRPA1 (0.32) | — | |
| SCHEMBL640643 | 0.80 | — | — | |
| SCHEMBL18699659 | 0.80 | — | — | |
| SCHEMBL18525822 | 0.74 | — | — | |
| SCHEMBL14190881 | 0.73 | — | — | |
| SCHEMBL13117364 | 0.73 | — | — | |
| SCHEMBL12993261 | 0.71 | — | — | |
| SCHEMBL16672193 | 0.71 | — | — | |
| SCHEMBL22388067 | 0.71 | — | — | |
| SCHEMBL25699982 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2427451-B1 | ALPHA HELIX MIMETICS AND METHODS RELATING THERETO | PRISM BIOLAB CO LTD (JP) | 2019-03-20 | — | — | EP | disclosed |