⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24188614 | 0.85 | — | — | |
| SCHEMBL24188617 | 0.68 | GPR3 (0.39) | — | |
| SCHEMBL14584046 | 0.66 | GPR3 (0.46) | — | |
| SCHEMBL24188660 | 0.65 | MAPT (0.36) | — | |
| SCHEMBL24188649 | 0.63 | NTRK1 (0.33) | — | |
| SCHEMBL14090800 | 0.63 | ADORA2A (0.30) | — | |
| SCHEMBL14090799 | 0.63 | ADORA2A (0.30) | — | |
| SCHEMBL24188635 | 0.63 | ADORA2A (0.36) | — | |
| SCHEMBL18775167 | 0.62 | MAPT (0.33) | — | |
| SCHEMBL20146546 | 0.62 | ADORA2A (0.33) | — |
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-20220013735-A1 | ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES | UNIVERSAL DISPLAY CORPORATION (US) | 2022-01-13 | — | — | US | disclosed |