⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3024181 | 0.73 | KCNH2 (0.39) | — | |
| SCHEMBL3020288 | 0.72 | RIPK1 (0.36) | — | |
| SCHEMBL3723303 | 0.69 | — | — | |
| SCHEMBL3023008 | 0.68 | HTR2C (0.32) | — | |
| SCHEMBL3724009 | 0.65 | GAA (0.33) | — | |
| SCHEMBL3724011 | 0.64 | GAA (0.33) | — | |
| SCHEMBL3012194 | 0.64 | RIPK1 (0.33) | — | |
| SCHEMBL3024862 | 0.63 | CA1 (0.39) | — | |
| SCHEMBL334990 | 0.62 | OPRL1 (0.41) | — | |
| SCHEMBL14042806 | 0.60 | — | — |
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-20100197679-A1 | COMPOUNDS | GLAXO GROUP LIMITED | 2010-08-05 | — | — | US | disclosed |