⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1427693 | 0.81 | — | — | |
| SCHEMBL140640 | 0.81 | — | — | |
| SCHEMBL12073718 | 0.75 | — | — | |
| SCHEMBL29364638 | 0.74 | — | — | |
| SCHEMBL654863 | 0.74 | — | — | |
| SCHEMBL11024032 | 0.74 | — | — | |
| SCHEMBL9009773 | 0.74 | — | — | |
| SCHEMBL17458015 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL29742915 | 0.72 | HSP90AB1 (0.47) | — | |
| SCHEMBL29742952 | 0.72 | HSP90AB1 (0.47) | — |
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-10577380-B2 | MK2 inhibitors and uses thereof | CELGENE CAR LLC (BM) | 2020-03-03 | — | — | US | disclosed |