⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15438433 | 0.70 | L3MBTL1 (0.33) | — | |
| SCHEMBL10010525 | 0.63 | MEN1 (0.34) | — | |
| SCHEMBL241533 | 0.62 | DGAT1 (0.46) | — | |
| SCHEMBL644646 | 0.62 | TSHR (0.45) | — | |
| Methyl Alcohol SCHEMBL27995686 | 0.61 | DGAT1 (0.44) | — | |
| SCHEMBL140085 | 0.61 | — | — | |
| SCHEMBL140084 | 0.61 | — | — | |
| SCHEMBL28378968 | 0.61 | ALDH1A1 (0.39) | — | |
| SCHEMBL63935 | 0.61 | — | — | |
| SCHEMBL29664142 | 0.60 | GAA (0.52) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5026862-A | Process for the preparation of 1.R, cis cyclopropane di-carboxylic acid derivatives | ROUSSEL UCLAF (FR) | 1991-06-25 | — | — | US | disclosed |
| EP-0094304-B1 | PROCESS FOR THE PREPARATION OF CYCLOPROPANECARBOXYLIC-ACID DERIVATIVES, AND INTERMEDIATES THEREFOR | ROUSSEL-UCLAF (FR) | 1986-03-12 | — | — | EP | disclosed |
| EP-0094304-A1 | Process for the preparation of cyclopropanecarboxylic-acid derivatives, and intermediates therefor | ROUSSEL-UCLAF (FR) | 1983-11-16 | — | — | EP | disclosed |