⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL250541 | 0.77 | EPHX2 (0.30) | — | |
| SCHEMBL27567572 | 0.73 | AKR1C1 (0.33) | — | |
| SCHEMBL7107826 | 0.71 | — | — | |
| SCHEMBL2352430 | 0.70 | AKR1C1 (0.35) | — | |
| SCHEMBL182249 | 0.69 | — | — | |
| SCHEMBL18094240 | 0.68 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL17721898 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL7586755 | 0.67 | — | — | |
| SCHEMBL27994036 | 0.65 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL2048192 | 0.63 | OPRM1 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115734779-A | Composition comprising a polyglycerol ester combination | 欧莱雅 | 2023-03-03 | — | — | CN | disclosed |
| CN-114845688-A | Retinol-based essence | 欧莱雅 | 2022-08-02 | — | — | CN | disclosed |
| CN-114845782-A | Retinol-based compositions | 欧莱雅 | 2022-08-02 | — | — | CN | disclosed |