⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22844044 | 0.81 | — | — | |
| SCHEMBL14198435 | 0.69 | — | — | |
| SCHEMBL28869194 | 0.69 | — | — | |
| SCHEMBL7963383 | 0.66 | — | — | |
| SCHEMBL22823329 | 0.64 | — | — | |
| SCHEMBL22429004 | 0.62 | — | — | |
| SCHEMBL6980833 | 0.62 | LMNA (0.43) | — | |
| SCHEMBL15173302 | 0.62 | — | — | |
| SCHEMBL7101219 | 0.61 | — | — | |
| SCHEMBL7965379 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9982009-B2 | Methods for treating polycystic kidney disease and polycystic liver disease | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2018-05-29 | — | — | US | disclosed |