⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11806982 | 0.78 | — | — | |
| SCHEMBL7743560 | 0.77 | — | — | |
| SCHEMBL3481788 | 0.73 | — | — | |
| SCHEMBL10623702 | 0.70 | — | — | |
| SCHEMBL16883515 | 0.69 | — | — | |
| SCHEMBL5052172 | 0.68 | NFKB1 (0.46) | — | |
| SCHEMBL5052175 | 0.68 | NFKB1 (0.46) | — | |
| SCHEMBL4081166 | 0.67 | — | — | |
| SCHEMBL3447068 | 0.67 | — | — | |
| SCHEMBL1263438 | 0.65 | — | — |
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-113444123-B | Ultraviolet absorbent and preparation method and application thereof | 广州集泰化工股份有限公司 | 2022-08-23 | — | — | CN | disclosed |
| CN-113444123-A | Ultraviolet absorbent and preparation method and application thereof | 广州集泰化工股份有限公司 | 2021-09-28 | — | — | CN | disclosed |
| CN-105331230-A | Environment-friendly waterproof coating and preparation method thereof | NINGBO SHENTAI DRY POWDER BUILDING MATERIALS CO LTD | 2016-02-17 | — | — | CN | disclosed |