⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3881256 | 0.78 | — | — | |
| SCHEMBL19858646 | 0.75 | — | — | |
| SCHEMBL17501930 | 0.70 | — | — | |
| SCHEMBL1304605 | 0.70 | — | — | |
| SCHEMBL17581115 | 0.69 | — | — | |
| SCHEMBL18656399 | 0.69 | — | — | |
| SCHEMBL21900389 | 0.66 | — | — | |
| SCHEMBL22628091 | 0.65 | — | — | |
| SCHEMBL1071912 | 0.63 | — | — | |
| SCHEMBL526288 | 0.63 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114181148-A | 'on-off' type fluorescent probe, preparation method and application thereof | 东北农业大学 | 2022-03-15 | — | — | CN | claimed |
| CN-114181148-B | 'on-off' type fluorescent probe, preparation method and application thereof | 东北农业大学 | 2022-08-05 | — | — | CN | disclosed |
| CN-114181148-A | 'on-off' type fluorescent probe, preparation method and application thereof | 东北农业大学 | 2022-03-15 | — | — | CN | disclosed |
| US-5547982-A | CONTAIN AT LEAST ONE FUNCTIONAL KETONE OR ALDEHYDE GROUP, OPTIONALLY CONJUGATED AS A LINKABLE HYDRAZONE COMPLEX | JOHNSON MATTHEY, INC. (US) | 1996-08-20 | — | — | US | disclosed |