⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26778877 | 0.93 | PRKDC (0.33) | — | |
| SCHEMBL24066206 | 0.90 | — | — | |
| SCHEMBL24255590 | 0.89 | MAPT (0.34) | — | |
| SCHEMBL25066600 | 0.89 | — | — | |
| SCHEMBL25978239 | 0.88 | PRKDC (0.33) | — | |
| SCHEMBL25975517 | 0.88 | S1PR5 (0.32) | — | |
| SCHEMBL24255618 | 0.88 | AHR (0.35) | — | |
| SCHEMBL26415592 | 0.87 | PRKDC (0.35) | — | |
| SCHEMBL24066150 | 0.87 | — | — | |
| SCHEMBL22330050 | 0.87 | PRKDC (0.36) | — |
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-20230337529-A1 | ORGANIC LIGHT-EMITTING DEVICE AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER | LT MATERIALS CO., LTD. (KR) | 2023-10-19 | — | — | US | disclosed |