⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29445827 | 0.80 | — | — | |
| SCHEMBL29445830 | 0.80 | — | — | |
| SCHEMBL29445824 | 0.66 | CNR2 (0.36) | — | |
| SCHEMBL29445812 | 0.66 | CNR2 (0.36) | — | |
| SCHEMBL1934176 | 0.64 | LMNA (0.36) | — | |
| SCHEMBL4595287 | 0.63 | GAA (0.47) | — | |
| SCHEMBL3230882 | 0.63 | GAA (0.47) | — | |
| SCHEMBL4595179 | 0.63 | GAA (0.47) | — | |
| SCHEMBL11147479 | 0.62 | HSPA5 (0.34) | — | |
| SCHEMBL30388052 | 0.61 | MEN1 (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-104937034-B | Daiamid composition and formed products | 旭化成株式会社 | 2016-08-24 | — | — | CN | disclosed |