⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11071870 | 0.86 | TSHR (0.30) | — | |
| SCHEMBL11078195 | 0.82 | HRH3 (0.34) | — | |
| SCHEMBL11074039 | 0.80 | PKM (0.30) | — | |
| SCHEMBL11105550 | 0.79 | HRH3 (0.37) | — | |
| SCHEMBL11075885 | 0.79 | — | — | |
| SCHEMBL11247695 | 0.78 | HRH4 (0.34) | — | |
| SCHEMBL11097319 | 0.77 | ALDH1A1 (0.42) | — | |
| SCHEMBL11076596 | 0.74 | KMT2A (0.45) | — | |
| SCHEMBL11069006 | 0.74 | EPHX1 (0.36) | — | |
| SCHEMBL11263936 | 0.73 | TSHR (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0026369-B1 | CARBAMATES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | BASF Aktiengesellschaft (DE) | 1984-08-08 | — | — | EP | disclosed |
| US-4335138-A | HYPNOTIC, SEDATIVE | BASF AKTIENGESELLSCHAFT (DE) | 1982-06-15 | — | — | US | disclosed |
| EP-0026369-A2 | Carbamates, their preparation and pharmaceutical compositions containing them | BASF Aktiengesellschaft (DE) | 1981-04-08 | — | — | EP | disclosed |