⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL166599 | 0.89 | — | — | |
| SCHEMBL11132999 | 0.80 | — | — | |
| SCHEMBL28824575 | 0.80 | — | — | |
| Ammonia Solution, Strong SCHEMBL3334928 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL9863746 | 0.80 | — | — | |
| SCHEMBL10354529 | 0.80 | — | — | |
| Hydrazine SCHEMBL9419988 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL10456032 | 0.80 | — | — | |
| SCHEMBL7648923 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL28745537 | 0.73 | — | — |
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-118090696-A | Preparation method and application of surface-enhanced Raman probe | 河北工程大学 | 2024-05-28 | — | — | CN | claimed |
| CN-118090696-A | Preparation method and application of surface-enhanced Raman probe | 河北工程大学 | 2024-05-28 | — | — | CN | disclosed |
| CN-118090696-A | Preparation method and application of surface-enhanced Raman probe | 河北工程大学 | 2024-05-28 | — | — | CN | disclosed |