⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17849625 | 0.82 | TNKS (0.33) | — | |
| SCHEMBL17849658 | 0.81 | SIGMAR1 (0.31) | — | |
| SCHEMBL18326019 | 0.80 | PLA2G2A (0.34) | — | |
| SCHEMBL18118689 | 0.80 | — | — | |
| SCHEMBL20466705 | 0.79 | MAPK1 (0.31) | — | |
| SCHEMBL18969078 | 0.79 | AHR (0.31) | — | |
| SCHEMBL18969066 | 0.79 | AHR (0.32) | — | |
| SCHEMBL17849626 | 0.79 | SIGMAR1 (0.31) | — | |
| SCHEMBL23769994 | 0.79 | PLA2G2A (0.32) | — | |
| SCHEMBL18969053 | 0.79 | CYP1A1 (0.31) | — |
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-9371270-B2 | Compound for organic light-emitting device and organic light-emitting device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-06-21 | — | — | US | disclosed |
| US-9371270-B2 | Compound for organic light-emitting device and organic light-emitting device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-06-21 | — | — | US | disclosed |