⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18965434 | 0.77 | — | — | |
| SCHEMBL15860822 | 0.74 | NOS2 (0.41) | — | |
| SCHEMBL19310436 | 0.72 | MEN1 (0.43) | — | |
| SCHEMBL24689811 | 0.71 | MEN1 (0.36) | — | |
| SCHEMBL23081915 | 0.71 | MEN1 (0.34) | — | |
| SCHEMBL24689394 | 0.70 | MEN1 (0.40) | — | |
| SCHEMBL27254247 | 0.70 | P2RX7 (0.35) | — | |
| SCHEMBL24689762 | 0.70 | MEN1 (0.36) | — | |
| SCHEMBL24689761 | 0.70 | MEN1 (0.39) | — | |
| SCHEMBL24715344 | 0.70 | MEN1 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3159350-A1 | ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES | Universal Display Corporation (US) | 2017-04-26 | — | — | EP | disclosed |