⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16070319 | 0.94 | MEN1 (0.33) | — | |
| SCHEMBL18774366 | 0.85 | MEN1 (0.35) | — | |
| SCHEMBL10104115 | 0.82 | KMT2A (0.43) | — | |
| SCHEMBL18774381 | 0.80 | MEN1 (0.41) | — | |
| SCHEMBL12869217 | 0.79 | MEN1 (0.37) | — | |
| SCHEMBL21005782 | 0.78 | MMP8 (0.32) | — | |
| SCHEMBL2314853 | 0.78 | MEN1 (0.45) | — | |
| SCHEMBL2314863 | 0.78 | MEN1 (0.45) | — | |
| SCHEMBL2314858 | 0.78 | MEN1 (0.45) | — | |
| SCHEMBL18774364 | 0.75 | LMNA (0.34) | — |
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-2018847-B1 | Hair composition comprising at least one direct disulfide dye and at least one alkali hydroxide agent and method of simultaneous styling and dyeing. | ORÉAL L (FR) | 2014-09-17 | — | — | EP | disclosed |