⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL129358 | 0.96 | — | — | |
| SCHEMBL29241787 | 0.93 | — | — | |
| Bromide SCHEMBL2510227 | 0.93 | — | — | |
| SCHEMBL29249842 | 0.80 | ALOX15 (0.33) | — | |
| SCHEMBL3503739 | 0.72 | KMT2A (0.68) | — | |
| SCHEMBL332318 | 0.72 | KMT2A (0.68) | — | |
| SCHEMBL1472304 | 0.72 | KMT2A (0.68) | — | |
| SCHEMBL738594 | 0.71 | — | — | |
| SCHEMBL12555811 | 0.70 | KMT2A (0.73) | — | |
| SCHEMBL296281 | 0.70 | KMT2A (0.73) | — |
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-2778218-B1 | NOVEL HOP POWDERS | STEINER INC S S (US) | 2018-12-05 | — | — | EP | disclosed |
| EP-2778218-A2 | Novel hop powders | S.S. STEINER, INC. (US) | 2014-09-17 | — | — | EP | disclosed |
| US-20140255587-A1 | NOVEL HOP POWDERS | S.S. STEINER, INC. (US) | 2014-09-11 | — | — | US | disclosed |