⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL997536 | 0.81 | — | — | |
| SCHEMBL21124040 | 0.73 | — | — | |
| SCHEMBL26908664 | 0.72 | — | — | |
| SCHEMBL22060514 | 0.69 | SIGMAR1 (0.31) | — | |
| SCHEMBL21909828 | 0.67 | SIGMAR1 (0.32) | — | |
| SCHEMBL21169296 | 0.65 | — | — | |
| SCHEMBL26019779 | 0.63 | — | — | |
| SCHEMBL12368090 | 0.63 | BIRC2 (0.33) | — | |
| SCHEMBL15248832 | 0.63 | GRIN2D (0.39) | — | |
| SCHEMBL278410 | 0.63 | GRIN2D (0.39) | — |
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-10632128-B2 | Compounds that inhibit Mcl-1 protein | AMGEN INC. (US) | 2020-04-28 | — | — | US | disclosed |