⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14866047 | 0.72 | — | — | |
| SCHEMBL1303850 | 0.71 | — | — | |
| SCHEMBL17482240 | 0.70 | EPHX1 (0.31) | — | |
| SCHEMBL18902364 | 0.68 | — | — | |
| SCHEMBL8122895 | 0.66 | — | — | |
| SCHEMBL22181805 | 0.62 | ALDH1A1 (0.36) | — | |
| SCHEMBL14967385 | 0.61 | TSHR (0.39) | — | |
| SCHEMBL18595260 | 0.61 | — | — | |
| SCHEMBL18595250 | 0.61 | — | — | |
| SCHEMBL12289197 | 0.61 | EPHX1 (0.31) | — |
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-8524919-B2 | Active polymeric filters | EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) | 2013-09-03 | — | — | US | disclosed |