⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28505111 | 0.78 | — | — | |
| SCHEMBL13962808 | 0.75 | — | — | |
| SCHEMBL17681915 | 0.75 | HDAC2 (0.33) | — | |
| SCHEMBL25107962 | 0.71 | — | — | |
| SCHEMBL13024642 | 0.71 | — | — | |
| SCHEMBL25912484 | 0.71 | — | — | |
| SCHEMBL14253814 | 0.69 | — | — | |
| SCHEMBL903415 | 0.69 | — | — | |
| SCHEMBL20629579 | 0.68 | EGFR (0.30) | — | |
| SCHEMBL26064069 | 0.67 | — | — |
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-3252060-B1 | METAL COMPLEX AND COLOR CONVERSION FILM COMPRISING SAME | LG CHEMICAL LTD (KR) | 2019-07-17 | — | — | EP | disclosed |