⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19014536 | 0.80 | — | — | |
| SCHEMBL20016781 | 0.78 | — | — | |
| SCHEMBL21737806 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL18669918 | 0.72 | — | — | |
| SCHEMBL14430844 | 0.71 | — | — | |
| SCHEMBL2353011 | 0.69 | — | — | |
| SCHEMBL12526115 | 0.68 | SYK (0.33) | — | |
| SCHEMBL18647890 | 0.68 | SYK (0.31) | — | |
| SCHEMBL19000628 | 0.65 | — | — | |
| SCHEMBL22540924 | 0.65 | — | — |
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-20210093611-A1 | COMPOUNDS USEFUL AS KINASE INHIBITORS | LOXO ONCOLOGY, INC. | 2021-04-01 | — | — | US | disclosed |