⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19727289 | 1.00 | — | — | |
| SCHEMBL19727312 | 1.00 | — | — | |
| SCHEMBL19763794 | 0.96 | — | — | |
| SCHEMBL19727288 | 0.95 | HRH3 (0.31) | — | |
| SCHEMBL19727291 | 0.95 | HRH3 (0.31) | — | |
| SCHEMBL19727290 | 0.95 | HRH3 (0.31) | — | |
| SCHEMBL19727297 | 0.92 | — | — | |
| SCHEMBL19727323 | 0.92 | — | — | |
| SCHEMBL19727298 | 0.92 | — | — | |
| SCHEMBL14524118 | 0.83 | HRH3 (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 |
|---|---|---|---|---|---|---|---|
| US-20170362217-A1 | Substituted Piperidine Compounds | Epizyme, Inc. (US) | 2017-12-21 | — | — | US | disclosed |