⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24135869 | 0.85 | — | — | |
| SCHEMBL10108367 | 0.85 | ALOX5 (0.34) | — | |
| SCHEMBL24992331 | 0.83 | ALOX5 (0.35) | — | |
| SCHEMBL10108357 | 0.83 | — | — | |
| SCHEMBL17125813 | 0.83 | — | — | |
| SCHEMBL17125790 | 0.82 | — | — | |
| SCHEMBL17125774 | 0.80 | — | — | |
| SCHEMBL20123077 | 0.79 | — | — | |
| SCHEMBL17125741 | 0.79 | — | — | |
| SCHEMBL10108418 | 0.78 | ALOX5 (0.35) | — |
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-2450975-B1 | Compound for organic optoelectronic device and organic light emitting diode including the same | CHEIL IND INC (KR) | 2014-01-08 | — | — | EP | disclosed |