⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19169632 | 0.74 | — | — | |
| SCHEMBL19161195 | 0.72 | HRH4 (0.37) | — | |
| SCHEMBL19162436 | 0.71 | HRH4 (0.38) | — | |
| SCHEMBL19161194 | 0.69 | HRH4 (0.43) | — | |
| SCHEMBL19169669 | 0.68 | HRH4 (0.38) | — | |
| SCHEMBL19169770 | 0.68 | HRH4 (0.38) | — | |
| SCHEMBL19161276 | 0.68 | HRH4 (0.44) | — | |
| SCHEMBL24700746 | 0.65 | TNKS (0.33) | — | |
| SCHEMBL21085535 | 0.65 | — | — | |
| SCHEMBL19169424 | 0.65 | HRH4 (0.43) | — |
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-10580998-B2 | Nitrogen-containing condensed cyclic compound and organic light emitting device using same | LG CHEM, LTD. (KR) | 2020-03-03 | — | — | US | disclosed |
| US-20190173022-A1 | NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | LG CHEM, LTD. (KR) | 2019-06-06 | — | — | US | disclosed |