⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20910620 | 0.79 | ESR1 (0.30) | — | |
| SCHEMBL20910612 | 0.75 | NQO1 (0.33) | — | |
| SCHEMBL20910601 | 0.74 | — | — | |
| SCHEMBL20910622 | 0.74 | MAPT (0.33) | — | |
| SCHEMBL20910623 | 0.74 | — | — | |
| SCHEMBL20910619 | 0.73 | ESR1 (0.30) | — | |
| SCHEMBL20911085 | 0.71 | CYP1A1 (0.46) | — | |
| SCHEMBL20910624 | 0.71 | — | — | |
| SCHEMBL20910600 | 0.71 | MAPT (0.31) | — | |
| SCHEMBL20910933 | 0.67 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11242357-B2 | Fused polycyclic heteroaromatic compound and organic thin film and electronic device | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2022-02-08 | — | — | US | disclosed |
| US-20190112319-A1 | FUSED POLYCYCLIC HETEROAROMATIC COMPOUND AND ORGANIC THIN FILM AND ELECTRONIC DEVICE | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2019-04-18 | — | — | US | disclosed |