⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9523706 | 0.92 | — | — | |
| SCHEMBL9523007 | 0.84 | — | — | |
| SCHEMBL9522006 | 0.84 | — | — | |
| SCHEMBL9522541 | 0.83 | SLC6A4 (0.38) | — | |
| SCHEMBL9522106 | 0.83 | — | — | |
| SCHEMBL9521920 | 0.82 | TAAR1 (0.31) | — | |
| SCHEMBL9522108 | 0.82 | SLC5A1 (0.31) | — | |
| SCHEMBL9212527 | 0.77 | — | — | |
| SCHEMBL9525054 | 0.77 | — | — | |
| SCHEMBL9521417 | 0.76 | SLC6A4 (0.36) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0211598-B1 | Pesticidal compounds | WELLCOME FOUND (GB) | 1993-12-15 | — | — | EP | claimed |
| US-4942173-A | INSECTICIDES, MITICIDES, BLEND WITH AN OXIDASE INHIBITOR | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1990-07-17 | — | — | US | claimed |
| EP-0211598-B1 | Pesticidal compounds | WELLCOME FOUND (GB) | 1993-12-15 | — | — | EP | disclosed |
| US-4942173-A | INSECTICIDES, MITICIDES, BLEND WITH AN OXIDASE INHIBITOR | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1990-07-17 | — | — | US | disclosed |
| EP-0211598-A2 | Pesticidal compounds | ROUSSEL-UCLAF (FR) | 1987-02-25 | — | — | EP | disclosed |