⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21913981 | 0.60 | — | — | |
| SCHEMBL22073772 | 0.59 | — | — | |
| SCHEMBL21913878 | 0.58 | — | — | |
| SCHEMBL21864431 | 0.55 | — | — | |
| SCHEMBL1259716 | 0.53 | POLB (0.54) | — | |
| SCHEMBL22958417 | 0.53 | — | — | |
| SCHEMBL10946904 | 0.52 | POLB (0.52) | — | |
| SCHEMBL11661917 | 0.52 | POLB (0.52) | — | |
| SCHEMBL9788883 | 0.51 | POLB (0.37) | — | |
| SCHEMBL2211047 | 0.51 | POLB (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3549944-A1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND | Samsung Electronics Co., Ltd. (KR) | 2019-10-09 | — | — | EP | disclosed |