⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10639329 | 0.82 | — | — | |
| SCHEMBL7924548 | 0.79 | — | — | |
| SCHEMBL106001 | 0.74 | — | — | |
| SCHEMBL532363 | 0.74 | HSD17B10 (0.33) | — | |
| SCHEMBL18369675 | 0.71 | NAAA (0.38) | — | |
| SCHEMBL2953068 | 0.69 | HSD17B10 (0.31) | — | |
| SCHEMBL25186147 | 0.69 | — | — | |
| SCHEMBL28450044 | 0.69 | TSHR (0.30) | — | |
| SCHEMBL27849597 | 0.68 | TSHR (0.44) | — | |
| Cyclopentane SCHEMBL9246282 | 0.67 | — | — |
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-1807431-A | Multiple functional radical silicide preparation method | HANGZHOU TEACHERS COLLEGE (CN) | 2006-07-26 | — | — | CN | disclosed |