⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL216824 | 0.74 | — | — | |
| SCHEMBL2277808 | 0.74 | — | — | |
| Carbamic Acid SCHEMBL27563073 | 0.74 | ACHE (0.41) | — | |
| SCHEMBL14738075 | 0.74 | — | — | |
| SCHEMBL1077168 | 0.74 | — | — | |
| SCHEMBL3812922 | 0.74 | — | — | |
| SCHEMBL27730460 | 0.74 | — | — | |
| SCHEMBL18814275 | 0.72 | — | — | |
| Methane SCHEMBL28280470 | 0.72 | — | — | |
| SCHEMBL22010789 | 0.72 | FFAR1 (0.30) | — |
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-0608393-B1 | HAIR DYES | WELLA AG (DE) | 1996-03-20 | — | — | EP | claimed |