⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21793386 | 0.86 | — | — | |
| SCHEMBL19980319 | 0.76 | — | — | |
| SCHEMBL23189073 | 0.76 | SLC6A2 (0.38) | — | |
| SCHEMBL22048699 | 0.75 | KDM4E (0.41) | — | |
| SCHEMBL21793544 | 0.70 | — | — | |
| SCHEMBL21793542 | 0.69 | — | — | |
| SCHEMBL27995398 | 0.68 | TSHR (0.35) | — | |
| SCHEMBL20344529 | 0.67 | KMT2A (0.41) | — | |
| SCHEMBL19980121 | 0.65 | SLC6A2 (0.40) | — | |
| SCHEMBL19980350 | 0.65 | SLC6A2 (0.40) | — |
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-2956452-B1 | HETEROCYCLIC AMIDES AS KINASE INHIBITORS | GLAXOSMITHKLINE IP DEV LTD (GB) | 2018-03-21 | — | — | EP | disclosed |