⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3285696 | 0.84 | MEN1 (0.32) | — | |
| SCHEMBL10095225 | 0.74 | ADRA2C (0.30) | — | |
| SCHEMBL12220326 | 0.66 | ADRA2C (0.32) | — | |
| SCHEMBL6837156 | 0.65 | MIF (0.35) | — | |
| SCHEMBL133474 | 0.65 | GSK3A (0.39) | — | |
| SCHEMBL1695372 | 0.64 | MAPT (0.36) | — | |
| SCHEMBL23625443 | 0.63 | ADRA2C (0.33) | — | |
| Water SCHEMBL11637323 | 0.62 | — | — | |
| SCHEMBL18536621 | 0.62 | MEN1 (0.30) | — | |
| SCHEMBL9678809 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3133062-A1 | PROCESS FOR THE PREPARATION OF A PHARMACEUTICAL AGENT | Zaklady Farmaceutyczne Polpharma SA (PL) | 2017-02-22 | — | — | EP | disclosed |