⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18763138 | 1.00 | — | — | |
| SCHEMBL20083502 | 1.00 | — | — | |
| SCHEMBL22754718 | 0.75 | — | — | |
| SCHEMBL22073515 | 0.75 | — | — | |
| SCHEMBL23987727 | 0.75 | — | — | |
| SCHEMBL17268151 | 0.73 | — | — | |
| SCHEMBL8179339 | 0.73 | — | — | |
| SCHEMBL13305461 | 0.73 | — | — | |
| SCHEMBL3134033 | 0.71 | — | — | |
| SCHEMBL19050057 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3613743-A1 | PROCESSES FOR THE PREPARATION OF 1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-AMINE DERIVATIVES | Intellikine, LLC (US) | 2020-02-26 | — | — | EP | disclosed |