⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21711249 | 0.81 | MGLL (0.35) | — | |
| SCHEMBL2618714 | 0.78 | MGLL (0.34) | — | |
| SCHEMBL21711246 | 0.77 | — | — | |
| SCHEMBL21711252 | 0.76 | KMT2A (0.37) | — | |
| SCHEMBL21711248 | 0.75 | HTT (0.31) | — | |
| SCHEMBL21711253 | 0.73 | — | — | |
| SCHEMBL22861286 | 0.72 | MTNR1A (0.33) | — | |
| SCHEMBL21711270 | 0.71 | KMT2A (0.33) | — | |
| SCHEMBL21711250 | 0.71 | KMT2A (0.33) | — | |
| SCHEMBL13183261 | 0.71 | BRD4 (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-20200050107-A1 | RESIST COMPOSITION AND PATTERNING PROCESS | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2020-02-13 | — | — | US | disclosed |