⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18101534 | 0.90 | LMNA (0.31) | — | |
| SCHEMBL4084612 | 0.89 | — | — | |
| SCHEMBL18101612 | 0.88 | CDC14B (0.30) | — | |
| SCHEMBL18101557 | 0.86 | ALOX5 (0.32) | — | |
| SCHEMBL4083875 | 0.85 | ALOX5 (0.32) | — | |
| SCHEMBL18101547 | 0.85 | ALOX5 (0.34) | — | |
| SCHEMBL18101549 | 0.84 | ALOX5 (0.32) | — | |
| SCHEMBL18101538 | 0.84 | TNKS (0.34) | — | |
| SCHEMBL18101647 | 0.83 | — | — | |
| SCHEMBL18101558 | 0.83 | TNKS (0.34) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160284998-A1 | NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE OBTAINED BY USING SAME | IDEMITSU KOSAN CO., LTD. (JP) | 2016-09-29 | — | — | US | disclosed |
| US-20160284998-A1 | NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE OBTAINED BY USING SAME | IDEMITSU KOSAN CO., LTD. (JP) | 2016-09-29 | — | — | US | disclosed |