⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28806148 | 0.81 | — | — | |
| SCHEMBL646646 | 0.80 | TSHR (0.30) | — | |
| SCHEMBL27511671 | 0.77 | TSHR (0.37) | — | |
| SCHEMBL27831123 | 0.76 | — | — | |
| SCHEMBL27602655 | 0.76 | — | — | |
| SCHEMBL106329 | 0.74 | — | — | |
| SCHEMBL18255495 | 0.73 | — | — | |
| Water SCHEMBL27808033 | 0.72 | — | — | |
| SCHEMBL27474057 | 0.70 | — | — | |
| SCHEMBL27473232 | 0.70 | — | — |
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-108291132-B | Etching composition and method for manufacturing semiconductor device using the same | 秀博瑞殷株式公社 | 2022-01-14 | — | — | CN | disclosed |