⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16787129 | 0.91 | DRD1 (0.32) | — | |
| SCHEMBL16786913 | 0.91 | PDK2 (0.32) | — | |
| SCHEMBL16786750 | 0.91 | DRD1 (0.32) | — | |
| SCHEMBL16786876 | 0.89 | DRD1 (0.33) | — | |
| SCHEMBL16787026 | 0.88 | DRD1 (0.32) | — | |
| SCHEMBL16787217 | 0.88 | PDK2 (0.32) | — | |
| SCHEMBL16787127 | 0.88 | PDK2 (0.32) | — | |
| SCHEMBL16786768 | 0.88 | DRD1 (0.34) | — | |
| SCHEMBL16787227 | 0.88 | ENPP3 (0.31) | — | |
| SCHEMBL16787221 | 0.87 | DRD1 (0.32) | — |
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-20150162542-A1 | COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE | SAMSUNG SDI CO., LTD. (KR) | 2015-06-11 | — | — | US | disclosed |
| US-20150162542-A1 | COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE | SAMSUNG SDI CO., LTD. (KR) | 2015-06-11 | — | — | US | disclosed |