⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20150621 | 0.91 | F9 (0.31) | — | |
| SCHEMBL20150603 | 0.91 | F9 (0.33) | — | |
| SCHEMBL20150608 | 0.90 | PPARG (0.33) | — | |
| SCHEMBL20150606 | 0.90 | MCL1 (0.33) | — | |
| SCHEMBL20150598 | 0.90 | PPARG (0.34) | — | |
| SCHEMBL20150609 | 0.89 | S1PR5 (0.32) | — | |
| SCHEMBL20150623 | 0.89 | CA12 (0.34) | — | |
| SCHEMBL20150629 | 0.88 | — | — | |
| SCHEMBL20150625 | 0.87 | CA12 (0.35) | — | |
| SCHEMBL20150597 | 0.87 | CA12 (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-10550134-B2 | Heterocyclic compound and organic electroluminescence device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2020-02-04 | — | — | US | disclosed |
| US-20180134732-A1 | HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2018-05-17 | — | — | US | disclosed |
| US-20180134732-A1 | HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2018-05-17 | — | — | US | disclosed |