⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19406444 | 0.70 | — | — | |
| SCHEMBL20994332 | 0.66 | — | — | |
| SCHEMBL18368888 | 0.63 | — | — | |
| SCHEMBL24637820 | 0.61 | — | — | |
| SCHEMBL23484845 | 0.60 | — | — | |
| SCHEMBL26081763 | 0.60 | — | — | |
| SCHEMBL15402435 | 0.59 | — | — | |
| SCHEMBL19393459 | 0.58 | LDHA (0.35) | — | |
| SCHEMBL24637759 | 0.57 | — | — | |
| SCHEMBL24637798 | 0.57 | TSHR (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022208370-A1 | FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS PEST CONTROL AGENTS | PI INDUSTRIES LTD. (IN) | 2022-10-06 | — | — | WO | disclosed |