⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10899960 | 0.80 | — | — | |
| SCHEMBL8979963 | 0.74 | DNM1 (0.33) | — | |
| SCHEMBL21442863 | 0.71 | — | — | |
| Alcohol SCHEMBL28582241 | 0.69 | LMNA (0.36) | — | |
| SCHEMBL7295779 | 0.69 | — | — | |
| SCHEMBL9427113 | 0.67 | MEN1 (0.42) | — | |
| SCHEMBL817983 | 0.67 | MEN1 (0.42) | — | |
| SCHEMBL12776508 | 0.67 | — | — | |
| SCHEMBL14712859 | 0.67 | — | — | |
| SCHEMBL3681640 | 0.67 | — | — |
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-10450303-B2 | Biaryl piperidine amide compounds and methods of use thereof | ATHENEX, INC. (US) | 2019-10-22 | — | — | US | disclosed |