⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20794097 | 0.99 | — | — | |
| SCHEMBL20272086 | 0.92 | — | — | |
| SCHEMBL21342116 | 0.89 | PDK2 (0.31) | — | |
| SCHEMBL19723456 | 0.86 | PDK2 (0.32) | — | |
| SCHEMBL18898039 | 0.82 | PDK2 (0.33) | — | |
| SCHEMBL21201803 | 0.80 | — | — | |
| SCHEMBL22747681 | 0.79 | TUBB4A (0.33) | — | |
| SCHEMBL19933577 | 0.79 | — | — | |
| SCHEMBL19933680 | 0.79 | — | — | |
| SCHEMBL22217191 | 0.78 | DUSP3 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9725476-B2 | Silylated metal complexes | UNIVERSAL DISPLAY CORPORATION (US) | 2017-08-08 | — | — | US | disclosed |
| US-9590194-B2 | Organic electroluminescent materials and devices | UNIVERSAL DISPLAY CORPORATION | 2017-03-07 | — | — | US | disclosed |