⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16623798 | 0.82 | CYP1A2 (0.32) | — | |
| SCHEMBL16623797 | 0.77 | — | — | |
| SCHEMBL16623783 | 0.71 | — | — | |
| SCHEMBL16623791 | 0.71 | — | — | |
| SCHEMBL16623843 | 0.70 | — | — | |
| SCHEMBL16623841 | 0.70 | — | — | |
| SCHEMBL16623833 | 0.69 | — | — | |
| SCHEMBL16623837 | 0.69 | — | — | |
| SCHEMBL16623814 | 0.69 | JAK2 (0.30) | — | |
| SCHEMBL16623816 | 0.69 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180047913-A1 | MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE | JNC CORPORATION (JP) | 2018-02-15 | — | — | US | disclosed |
| US-9741950-B2 | Polycyclic aromatic compound | KYOTO UNIVERSITY (JP) | 2017-08-22 | — | — | US | disclosed |
| US-20160049600-A1 | POLYCYCLIC AROMATIC COMPOUND | SK MATERIALS JNC CO., LTD. (KR) | 2016-02-18 | — | — | US | disclosed |
| US-9166176-B2 | Polycyclic aromatic compound | KYOTO UNIVERSITY (JP) | 2015-10-20 | — | — | US | disclosed |
| US-20150097162-A1 | MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE | JNC CORPORATION (JP) | 2015-04-09 | — | — | US | disclosed |