⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2085603 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL313364 | 0.72 | — | — | |
| SCHEMBL8239151 | 0.66 | ALOX5 (0.34) | — | |
| SCHEMBL19087041 | 0.65 | TDP1 (0.31) | — | |
| SCHEMBL14733936 | 0.64 | — | — | |
| SCHEMBL14658477 | 0.64 | — | — | |
| SCHEMBL3924268 | 0.61 | — | — | |
| SCHEMBL2202738 | 0.61 | — | — | |
| SCHEMBL69923 | 0.61 | — | — | |
| SCHEMBL17148735 | 0.59 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2797918-A1 | BROMODOMAIN INHIBITORS | AbbVie Inc. (US) | 2014-11-05 | — | — | EP | disclosed |
| WO-2013097052-A1 | BROMODOMAIN INHIBITORS | ABBOTT LABORATORIES (US) | 2013-07-04 | — | — | WO | disclosed |
| WO-2013097601-A1 | BROMODOMAIN INHIBITORS | ABBVIE INC. (US) | 2013-07-04 | — | — | WO | disclosed |