⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21335629 | 0.83 | — | — | |
| SCHEMBL21706460 | 0.79 | — | — | |
| SCHEMBL20042506 | 0.77 | EGFR (0.39) | — | |
| SCHEMBL21706340 | 0.77 | — | — | |
| SCHEMBL24637682 | 0.75 | — | — | |
| SCHEMBL24637708 | 0.74 | — | — | |
| SCHEMBL21706452 | 0.74 | — | — | |
| SCHEMBL21335623 | 0.74 | — | — | |
| SCHEMBL21706450 | 0.74 | — | — | |
| SCHEMBL21335632 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018065350-A1 | ORGANIC SEMICONDUCTING COMPOUNDS | MERCK PATENT GMBH (DE) | 2018-04-12 | — | — | WO | disclosed |