⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18910977 | 0.77 | — | — | |
| SCHEMBL687260 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL519119 | 0.71 | — | — | |
| SCHEMBL15426781 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL17074780 | 0.71 | — | — | |
| SCHEMBL10855840 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL28313889 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL27874946 | 0.69 | — | — | |
| SCHEMBL19930246 | 0.69 | PRMT3 (0.31) | — | |
| SCHEMBL19930485 | 0.69 | PRMT3 (0.31) | — |
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-3295819-A1 | COLORED HAIR ORNAMENT, METHOD AND KIT THEREOF | The Procter and Gamble Company (US) | 2018-03-21 | — | — | EP | disclosed |