⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21911813 | 0.83 | HDAC3 (0.30) | — | |
| SCHEMBL19756174 | 0.82 | — | — | |
| SCHEMBL23065534 | 0.82 | HDAC3 (0.33) | — | |
| SCHEMBL23843750 | 0.81 | — | — | |
| SCHEMBL19756198 | 0.80 | SERPINE1 (0.31) | — | |
| SCHEMBL19756007 | 0.80 | — | — | |
| SCHEMBL19756177 | 0.80 | — | — | |
| SCHEMBL26068000 | 0.78 | POLB (0.31) | — | |
| SCHEMBL26343818 | 0.78 | VCP (0.35) | — | |
| SCHEMBL19756173 | 0.77 | FGFR1 (0.32) | — |
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-20170369616-A1 | RESIST COMPOSITION AND PATTERNING PROCESS | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2017-12-28 | — | — | US | disclosed |