⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25563647 | 0.90 | GPR3 (0.36) | — | |
| SCHEMBL24647507 | 0.89 | GPR3 (0.32) | — | |
| SCHEMBL21037615 | 0.89 | GPR3 (0.32) | — | |
| SCHEMBL20114722 | 0.88 | ALOX5 (0.33) | — | |
| SCHEMBL25563596 | 0.87 | GPR3 (0.33) | — | |
| SCHEMBL25563532 | 0.87 | GPR3 (0.33) | — | |
| SCHEMBL20109643 | 0.87 | GPR3 (0.39) | — | |
| SCHEMBL14681291 | 0.86 | GPR3 (0.34) | — | |
| SCHEMBL16544721 | 0.85 | GPR3 (0.33) | — | |
| SCHEMBL25661591 | 0.84 | — | — |
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-20180123048-A1 | COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF | DUK SAN NEOLUX CO., LTD. (KR) | 2018-05-03 | — | — | US | disclosed |