⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4095770 | 0.87 | — | — | |
| SCHEMBL10476676 | 0.87 | — | — | |
| SCHEMBL4095760 | 0.87 | — | — | |
| SCHEMBL8536926 | 0.83 | — | — | |
| SCHEMBL8538898 | 0.83 | — | — | |
| SCHEMBL8544220 | 0.83 | — | — | |
| SCHEMBL9309452 | 0.78 | — | — | |
| SCHEMBL8537417 | 0.77 | CYP3A4 (0.36) | — | |
| SCHEMBL8536971 | 0.77 | — | — | |
| SCHEMBL8538649 | 0.77 | — | — |
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-0358154-B1 | Novel cyclobutane derivative and process for producing same | NIPPON KAYAKU KK (JP) | 1998-12-02 | — | — | EP | disclosed |
| EP-0358154-A2 | Novel cyclobutane derivative and process for producing same | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1990-03-14 | — | — | EP | disclosed |