⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17125774 | 0.89 | — | — | |
| SCHEMBL10108384 | 0.89 | PDK2 (0.30) | — | |
| SCHEMBL10108357 | 0.88 | — | — | |
| SCHEMBL17125813 | 0.88 | — | — | |
| SCHEMBL17125790 | 0.87 | — | — | |
| SCHEMBL17125741 | 0.86 | — | — | |
| SCHEMBL19760360 | 0.82 | — | — | |
| SCHEMBL17125777 | 0.82 | — | — | |
| SCHEMBL17125738 | 0.82 | — | — | |
| SCHEMBL17125720 | 0.82 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220407010-A1 | COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE | SAMSUNG SDI CO., LTD. (KR) | 2022-12-22 | — | — | US | disclosed |