⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30605761 | 0.75 | — | — | |
| SCHEMBL82219 | 0.71 | — | — | |
| SCHEMBL13116775 | 0.71 | — | — | |
| SCHEMBL18256132 | 0.71 | — | — | |
| SCHEMBL81819 | 0.71 | — | — | |
| SCHEMBL24342600 | 0.71 | — | — | |
| SCHEMBL14110736 | 0.71 | — | — | |
| SCHEMBL29648909 | 0.69 | — | — | |
| SCHEMBL12427405 | 0.69 | — | — | |
| SCHEMBL15109450 | 0.69 | SIGMAR1 (0.37) | — |
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-2476667-A2 | Aminoheteroaryl compounds as protein kinase inhibitors | Sugen, Inc. (US) | 2012-07-18 | — | — | EP | disclosed |