⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10550737 | 0.83 | BTK (0.30) | — | |
| SCHEMBL10550187 | 0.78 | — | — | |
| SCHEMBL10546278 | 0.74 | — | — | |
| SCHEMBL10545607 | 0.73 | — | — | |
| SCHEMBL11039158 | 0.73 | — | — | |
| SCHEMBL10546984 | 0.70 | TSHR (0.34) | — | |
| SCHEMBL10547245 | 0.70 | LMNA (0.36) | — | |
| SCHEMBL10545215 | 0.69 | APLNR (0.30) | — | |
| SCHEMBL11133574 | 0.69 | — | — | |
| SCHEMBL10574259 | 0.69 | HTT (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0038271-B1 | CYCLOPROPANE CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND USE IN COMBATING PARASITES OF PLANTS AND ANIMALS, THEIR COMPOSITIONS AND INTERMEDIATES | ROUSSEL-UCLAF (FR) | 1984-07-04 | — | — | EP | disclosed |
| US-4402972-A | INSECTICIDES | ROUSSEL UCLAF (FR) | 1983-09-06 | — | — | US | disclosed |