⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19099831 | 1.00 | — | — | |
| SCHEMBL22702460 | 1.00 | — | — | |
| SCHEMBL6635846 | 0.82 | GBA1 (0.40) | — | |
| SCHEMBL9052252 | 0.82 | GBA1 (0.40) | — | |
| Hydrochloric Acid SCHEMBL15463591 | 0.79 | GBA1 (0.39) | — | |
| Hydrochloric Acid SCHEMBL15463590 | 0.79 | GBA1 (0.39) | — | |
| SCHEMBL13404486 | 0.78 | — | — | |
| SCHEMBL10935420 | 0.78 | — | — | |
| SCHEMBL90792 | 0.76 | — | — | |
| SCHEMBL13116329 | 0.76 | GBA1 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210323975-A1 | CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS | VALO EARLY DISCOVERY, INC. | 2021-10-21 | — | — | US | disclosed |
| WO-2017120164-A1 | FUSED QUADRACYCLIC COMPOUNDS, COMPOSITIONS AND USES THEREOF | Tabomedex Biosciences, LLC (US) | 2017-07-13 | — | — | WO | disclosed |
| US-20170190713-A1 | FUSED QUADRACYCLIC COMPOUNDS, COMPOSITIONS AND USES THEREOF | WUXI APPTEC (HONG KONG) CO., LIMITED (HK) | 2017-07-06 | — | — | US | disclosed |