⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24777403 | 0.95 | — | — | |
| SCHEMBL24776667 | 0.95 | — | — | |
| SCHEMBL24777407 | 0.93 | — | — | |
| SCHEMBL24777395 | 0.93 | NQO2 (0.30) | — | |
| SCHEMBL24776955 | 0.91 | SOS1 (0.36) | — | |
| SCHEMBL24777392 | 0.89 | CYP1A1 (0.30) | — | |
| SCHEMBL24776566 | 0.89 | SOS1 (0.36) | — | |
| SCHEMBL24776553 | 0.89 | SOS1 (0.36) | — | |
| SCHEMBL24777405 | 0.88 | — | — | |
| SCHEMBL24781380 | 0.87 | SOS1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022264826-A1 | COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2022-12-22 | — | — | WO | disclosed |