⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12758187 | 0.88 | LMNA (0.35) | — | |
| SCHEMBL17447694 | 0.86 | ALDH1A1 (0.39) | — | |
| SCHEMBL21128880 | 0.86 | ALDH1A1 (0.39) | — | |
| SCHEMBL21128879 | 0.84 | NR1H2 (0.32) | — | |
| SCHEMBL12758190 | 0.79 | MAPK1 (0.33) | — | |
| SCHEMBL12101246 | 0.79 | MAPK1 (0.33) | — | |
| SCHEMBL12268506 | 0.78 | — | — | |
| SCHEMBL12268364 | 0.78 | — | — | |
| SCHEMBL12758191 | 0.71 | KMT2A (0.46) | — | |
| SCHEMBL14615681 | 0.69 | GAA (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2272490-B1 | Stabilization of body-care and household products against degradation by UV radiation using merocyanine derivatives | BASF SE (DE) | 2019-10-16 | — | — | EP | disclosed |