⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28004672 | 0.85 | — | — | |
| SCHEMBL29226047 | 0.67 | LMNA (0.32) | — | |
| SCHEMBL2401093 | 0.66 | ALDH1A1 (0.36) | — | |
| SCHEMBL614666 | 0.65 | HRH3 (0.50) | — | |
| SCHEMBL1229250 | 0.65 | HRH3 (0.50) | — | |
| SCHEMBL15534966 | 0.65 | HRH3 (0.32) | — | |
| SCHEMBL20656534 | 0.65 | — | — | |
| SCHEMBL759054 | 0.64 | LMNA (0.32) | — | |
| SCHEMBL4447945 | 0.64 | MAPT (0.40) | — | |
| SCHEMBL11402560 | 0.63 | KDM4E (0.33) | — |
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-104321359-A | Polymers containing silane groups | SIKA TECHNOLOGY AG | 2015-01-28 | — | — | CN | disclosed |