⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19768625 | 0.90 | CYP1A2 (0.32) | — | |
| SCHEMBL19768647 | 0.90 | ALDH1A1 (0.34) | — | |
| SCHEMBL19768627 | 0.88 | KDM4E (0.31) | — | |
| SCHEMBL19768658 | 0.88 | PDK2 (0.34) | — | |
| SCHEMBL19768634 | 0.87 | MAPT (0.38) | — | |
| SCHEMBL19768635 | 0.87 | PDK2 (0.35) | — | |
| SCHEMBL19768641 | 0.85 | — | — | |
| SCHEMBL22646802 | 0.85 | KDM4E (0.30) | — | |
| SCHEMBL12170879 | 0.84 | KDM4E (0.36) | — | |
| SCHEMBL12170843 | 0.84 | KDM4E (0.36) | — |
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-11133469-B2 | Compounds for organic optoelectronic device and organic optoelectronic device including the same | UNIVERSITY-INDUSTRY COOPERATION GROUP OF KYUNG HEE UNIVERSITY (KR) | 2021-09-28 | — | — | US | disclosed |
| US-20180019403-A1 | COMPOUNDS FOR ORGANIC OPTOELECTRONIC DEVICE AND ORGANIC OPTOELECTRONIC DEVICE INCLUDING THE SAME | UNIVERSITY-INDUSTRY COOPERATION GROUP OF KYUNG HEE UNIVERSITY (KR) | 2018-01-18 | — | — | US | disclosed |
| US-20180019403-A1 | COMPOUNDS FOR ORGANIC OPTOELECTRONIC DEVICE AND ORGANIC OPTOELECTRONIC DEVICE INCLUDING THE SAME | UNIVERSITY-INDUSTRY COOPERATION GROUP OF KYUNG HEE UNIVERSITY (KR) | 2018-01-18 | — | — | US | disclosed |