⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL154363 | 0.89 | — | — | |
| SCHEMBL723150 | 0.89 | — | — | |
| SCHEMBL38654739 | 0.80 | — | — | |
| SCHEMBL21404606 | 0.80 | — | — | |
| SCHEMBL28388338 | 0.80 | — | — | |
| SCHEMBL31115310 | 0.80 | — | — | |
| SCHEMBL27407744 | 0.80 | — | — | |
| SCHEMBL6454459 | 0.80 | — | — | |
| SCHEMBL28091140 | 0.80 | — | — | |
| SCHEMBL18815988 | 0.78 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113548872-A | IWO target material and preparation method and application thereof | 长沙壹纳光电材料有限公司 | 2021-10-26 | — | — | CN | disclosed |