⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14460328 | 1.00 | — | — | |
| SCHEMBL14460488 | 0.98 | — | — | |
| SCHEMBL14460470 | 0.98 | — | — | |
| SCHEMBL14460345 | 0.94 | — | — | |
| SCHEMBL14460355 | 0.93 | — | — | |
| SCHEMBL14460338 | 0.93 | — | — | |
| SCHEMBL14460332 | 0.92 | KDM4E (0.36) | — | |
| SCHEMBL14460481 | 0.92 | KDM4E (0.36) | — | |
| SCHEMBL14460213 | 0.91 | KDM4E (0.33) | — | |
| SCHEMBL14460267 | 0.91 | KDM4E (0.33) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8431251-B2 | Heterocyclic compound and organic light-emitting device comprising the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2013-04-30 | — | — | US | disclosed |
| US-20130001524-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME | SAMSUNG MOBILE DISPLAY CO., LTD. (KR) | 2013-01-03 | — | — | US | disclosed |
| US-20130001524-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME | SAMSUNG MOBILE DISPLAY CO., LTD. (KR) | 2013-01-03 | — | — | US | disclosed |