⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20737577 | 0.98 | — | — | |
| SCHEMBL20736394 | 0.91 | PDK2 (0.32) | — | |
| SCHEMBL20736132 | 0.90 | PDK2 (0.32) | — | |
| SCHEMBL27251139 | 0.90 | HPRT1 (0.33) | — | |
| SCHEMBL20737768 | 0.90 | SOS1 (0.32) | — | |
| SCHEMBL20737301 | 0.90 | SOS1 (0.32) | — | |
| SCHEMBL20737745 | 0.89 | — | — | |
| SCHEMBL27250895 | 0.89 | PDK2 (0.30) | — | |
| SCHEMBL27250265 | 0.88 | — | — | |
| SCHEMBL20737783 | 0.88 | — | — |
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-12022728-B2 | Organic electroluminescent element and electronic device | IDEMITSU KOSAN CO., LTD. (JP) | 2024-06-25 | — | — | US | disclosed |