⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21649852 | 1.00 | — | — | |
| SCHEMBL12527135 | 0.78 | — | — | |
| SCHEMBL22540924 | 0.78 | — | — | |
| SCHEMBL16808871 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL22528036 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL21462724 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL31343799 | 0.76 | — | — | |
| SCHEMBL24096592 | 0.75 | — | — | |
| SCHEMBL24659821 | 0.75 | — | — | |
| SCHEMBL15533482 | 0.75 | — | — |
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-3692026-B1 | BENZOFURAN DERIVATIVES AND THEIR USE AS BROMODOMAIN INHIBITORS. | GLAXOSMITHKLINE IP NO 2 LTD (GB) | 2022-07-06 | — | — | EP | disclosed |