⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5172548 | 0.75 | — | — | |
| SCHEMBL4423842 | 0.73 | CA12 (0.33) | — | |
| SCHEMBL4953189 | 0.70 | ACHE (0.40) | — | |
| SCHEMBL30645310 | 0.70 | ACHE (0.40) | — | |
| SCHEMBL4426155 | 0.66 | GPR35 (0.30) | — | |
| SCHEMBL4949317 | 0.65 | CDC7 (0.44) | — | |
| SCHEMBL17265928 | 0.65 | GAA (0.40) | — | |
| SCHEMBL4955145 | 0.65 | PRKCI (0.36) | — | |
| SCHEMBL17265872 | 0.62 | FLT3 (0.59) | — | |
| SCHEMBL4421187 | 0.60 | APP (0.31) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20200321533-A1 | COMPOUNDS FOR ORGANIC LIGHT EMITTING DIODE MATERIALS | THE SCRIPPS RESEARCH INSTITUTE | 2020-10-08 | — | — | US | disclosed |
| US-20170244049-A1 | ORGANIC LIGHT-EMITTING DIODE MATERIALS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2017-08-24 | — | — | US | disclosed |
| WO-2017011531-A2 | ORGANIC LIGHT-EMITTING DIODE MATERIALS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2017-01-19 | — | — | WO | disclosed |
| WO-2015175678-A1 | ORGANIC LIGHT-EMITTING DIODE MATERIALS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2015-11-19 | — | — | WO | disclosed |