⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27696092 | 0.81 | — | — | |
| SCHEMBL28930319 | 0.81 | — | — | |
| SCHEMBL28669314 | 0.79 | — | — | |
| SCHEMBL27856428 | 0.79 | — | — | |
| SCHEMBL733610 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL27677500 | 0.78 | — | — | |
| SCHEMBL23931181 | 0.77 | — | — | |
| SCHEMBL381790 | 0.75 | — | — | |
| SCHEMBL2065723 | 0.74 | — | — | |
| SCHEMBL8380506 | 0.74 | ALDH1A1 (0.34) | — |
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-101128531-A | Power or communication cable with flame retardant polymer layer | BOREALIS TECH OY (FI) | 2008-02-20 | — | — | CN | disclosed |