⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2864943 | 0.71 | — | — | |
| SCHEMBL16497105 | 0.70 | — | — | |
| SCHEMBL10396186 | 0.67 | — | — | |
| SCHEMBL16497036 | 0.65 | — | — | |
| SCHEMBL18552951 | 0.64 | — | — | |
| SCHEMBL10629840 | 0.64 | TSHR (0.35) | — | |
| SCHEMBL6842120 | 0.64 | — | — | |
| SCHEMBL3958186 | 0.62 | TRPM8 (0.35) | — | |
| SCHEMBL143035 | 0.62 | — | — | |
| SCHEMBL13799630 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4958041-A | FROM TETRAALKOXYSILANE OR MONOORGANOTRIALKOXYSILANE AND GRIGNARD | SCHERING AKTIENGESELLSCHAFT (DE) | 1990-09-18 | — | — | US | disclosed |