⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16850631 | 0.78 | — | — | |
| SCHEMBL4356709 | 0.76 | — | — | |
| SCHEMBL5429339 | 0.76 | — | — | |
| SCHEMBL343264 | 0.76 | — | — | |
| SCHEMBL1075241 | 0.76 | — | — | |
| SCHEMBL4527805 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL1382983 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL1049688 | 0.74 | TSHR (0.39) | — | |
| SCHEMBL17850579 | 0.73 | — | — | |
| SCHEMBL1270987 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016092375-A1 | SUBSTITUTED HETEROCYCLES AS BROMODOMAIN INHIBITORS | ZENITH EPIGENETICS CORP. (CA) | 2016-06-16 | — | — | WO | disclosed |