⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9704318 | 1.00 | — | — | |
| SCHEMBL7624875 | 0.77 | — | — | |
| SCHEMBL4660525 | 0.73 | APLNR (0.35) | — | |
| SCHEMBL2328773 | 0.73 | GAA (0.40) | — | |
| SCHEMBL28684224 | 0.73 | CHRM2 (0.40) | — | |
| SCHEMBL10499953 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL25382273 | 0.72 | APLNR (0.48) | — | |
| SCHEMBL3046866 | 0.72 | MAPK1 (0.30) | — | |
| SCHEMBL4662031 | 0.69 | LMNA (0.35) | — | |
| SCHEMBL4660719 | 0.69 | NR1I2 (0.31) | — |
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-0498724-B1 | Esters of 3-(3,3,3-trifluoro-2-chloropropenyl)-2,2-dimethyl-cyclopropanecarboxylic acid, process for their preparation and their use as pesticides | ROUSSEL UCLAF (FR) | 1996-05-15 | — | — | EP | claimed |