⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL11556496 | 0.98 | — | — | |
| SCHEMBL4597101 | 0.81 | POLB (0.31) | — | |
| Bicarbonate SCHEMBL9447127 | 0.78 | — | — | |
| SCHEMBL5838798 | 0.76 | — | — | |
| SCHEMBL30586002 | 0.76 | NAAA (0.32) | — | |
| SCHEMBL340771 | 0.76 | — | — | |
| SCHEMBL1901109 | 0.76 | — | — | |
| SCHEMBL23174626 | 0.70 | — | — | |
| SCHEMBL4845814 | 0.69 | — | — | |
| SCHEMBL5964599 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1990006905-A1 | WHISKER-REINFORCED CERAMIC AND SUPERCONDUCTOR FIBERS FROM PRECERAMIC SOL-GEL, LIQUID MIX, AND POLYMER PRECURSORS | THE BOEING COMPANY (US) | 1990-06-28 | — | — | WO | disclosed |