⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24618009 | 0.84 | HTT (0.30) | — | |
| SCHEMBL25038722 | 0.80 | — | — | |
| SCHEMBL17425567 | 0.75 | LIMK1 (0.42) | — | |
| SCHEMBL25038840 | 0.74 | — | — | |
| SCHEMBL24703258 | 0.74 | ALOX5 (0.43) | — | |
| SCHEMBL17425577 | 0.74 | LIMK1 (0.43) | — | |
| SCHEMBL17057197 | 0.72 | ALOX5 (0.43) | — | |
| SCHEMBL17425588 | 0.72 | ALOX5 (0.43) | — | |
| SCHEMBL30020081 | 0.72 | ALOX5 (0.43) | — | |
| SCHEMBL17425548 | 0.72 | LIMK1 (0.45) | — |
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-20220223796-A1 | ORGANIC COMPOUND, ELECTRONIC COMPONENT CONTAINING ORGANIC COMPOUND, AND ELECTRONIC DEVICE | SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) | 2022-07-14 | — | — | US | disclosed |