⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11028186 | 1.00 | — | — | |
| Bicarbonate SCHEMBL9704357 | 0.92 | APLNR (0.30) | — | |
| SCHEMBL8657663 | 0.82 | — | — | |
| SCHEMBL8661957 | 0.82 | — | — | |
| SCHEMBL8999407 | 0.82 | — | — | |
| SCHEMBL8657669 | 0.82 | — | — | |
| SCHEMBL9232323 | 0.79 | — | — | |
| SCHEMBL9568933 | 0.76 | — | — | |
| SCHEMBL25261479 | 0.76 | MEN1 (0.32) | — | |
| SCHEMBL3365310 | 0.76 | MEN1 (0.32) | — |
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-0043143-B1 | PROCESS FOR STEREOSELECTIVELY SYNTHETIZING CYCLOPROPANE CARBOXYLATES AS INTERMEDIATES FOR PYRETHROIDS | Montedison S.p.A. (IT) | 1985-06-19 | — | — | EP | disclosed |