⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12015993 | 1.00 | — | — | |
| SCHEMBL166692 | 0.73 | — | — | |
| SCHEMBL13618608 | 0.73 | — | — | |
| SCHEMBL166691 | 0.73 | — | — | |
| SCHEMBL18369115 | 0.73 | — | — | |
| SCHEMBL16091368 | 0.73 | — | — | |
| SCHEMBL12164469 | 0.73 | — | — | |
| SCHEMBL20124925 | 0.73 | — | — | |
| SCHEMBL23130710 | 0.71 | — | — | |
| SCHEMBL7368079 | 0.71 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3494093-B1 | METHODS AND USES OF DISSOLVED ORGANIC MATERIAL FRACTIONS FOR BINDING METAL IONS | NOBLEGEN INC (CA) | 2022-05-18 | — | — | EP | disclosed |
| WO-2020257143-A1 | PYRAZOLOPYRIMIDINE ARYL ETHER INHIBITORS OF JAK KINASES AND USES THEREOF | GENENTECH, INC. (US) | 2020-12-24 | — | — | WO | disclosed |