⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19797409 | 0.89 | NPSR1 (0.32) | — | |
| SCHEMBL19797405 | 0.87 | FAAH (0.33) | — | |
| SCHEMBL19797407 | 0.84 | NPSR1 (0.32) | — | |
| SCHEMBL19805153 | 0.83 | KCNN4 (0.36) | — | |
| SCHEMBL19797408 | 0.82 | NPSR1 (0.32) | — | |
| SCHEMBL19797414 | 0.82 | ITGB2 (0.33) | — | |
| SCHEMBL19797406 | 0.82 | NPSR1 (0.33) | — | |
| SCHEMBL19797377 | 0.80 | NPSR1 (0.31) | — | |
| SCHEMBL14595501 | 0.78 | KDM4E (0.39) | — | |
| SCHEMBL19797401 | 0.77 | ALDH1A1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10388889-B2 | Substituted phosphines as components of organic light-emitting devices | SAMSUNG DISPLAY CO., LTD. (KR) | 2019-08-20 | — | — | US | disclosed |
| US-20180026206-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2018-01-25 | — | — | US | disclosed |
| US-20180026206-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2018-01-25 | — | — | US | disclosed |