⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18967416 | 0.83 | FGFR1 (0.30) | — | |
| SCHEMBL15034684 | 0.80 | RXRA (0.32) | — | |
| SCHEMBL15860616 | 0.79 | — | — | |
| SCHEMBL15338020 | 0.75 | HDAC4 (0.36) | — | |
| SCHEMBL15338019 | 0.75 | KDM4E (0.38) | — | |
| SCHEMBL15338022 | 0.75 | KDM4E (0.38) | — | |
| SCHEMBL15590618 | 0.75 | HDAC4 (0.34) | — | |
| SCHEMBL15337959 | 0.73 | KDM4E (0.38) | — | |
| SCHEMBL15137567 | 0.72 | KDM4E (0.35) | — | |
| SCHEMBL15358277 | 0.71 | ALOX5 (0.40) | — |
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-2020036375-A1 | ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2020-02-20 | — | — | WO | disclosed |