⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL67846 | 0.95 | — | — | |
| Hydrogen Sulfide SCHEMBL27649694 | 0.91 | — | — | |
| Ammonia Solution, Strong SCHEMBL28253347 | 0.91 | — | — | |
| SCHEMBL11072942 | 0.91 | — | — | |
| Methane SCHEMBL27336272 | 0.91 | — | — | |
| SCHEMBL27587062 | 0.91 | — | — | |
| Cyclopentane SCHEMBL7740535 | 0.84 | — | — | |
| Methylamine SCHEMBL27303827 | 0.84 | — | — | |
| Butadiene SCHEMBL28847089 | 0.81 | — | — | |
| Trimethylammonium SCHEMBL27504976 | 0.81 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114306185-B | Photochromic-resistant composition and preparation method thereof, whitening anti-wrinkle essence and preparation method thereof | 广州市瑞芬化妆品有限公司 | 2023-06-27 | — | — | CN | disclosed |
| CN-114306185-A | Anti-photochromic composition and preparation method thereof, and whitening and anti-wrinkle essence and preparation method thereof | 广州市瑞芬化妆品有限公司 | 2022-04-12 | — | — | CN | disclosed |