⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26939771 | 0.95 | — | — | |
| SCHEMBL26939772 | 0.95 | — | — | |
| SCHEMBL26939773 | 0.93 | MAPT (0.32) | — | |
| SCHEMBL23365365 | 0.82 | — | — | |
| SCHEMBL26939897 | 0.81 | RBP4 (0.35) | — | |
| SCHEMBL4829842 | 0.80 | NPSR1 (0.31) | — | |
| SCHEMBL23293553 | 0.78 | CYP2C19 (0.32) | — | |
| SCHEMBL26939794 | 0.77 | — | — | |
| SCHEMBL22373501 | 0.77 | — | — | |
| SCHEMBL7884001 | 0.77 | CYP2C19 (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230400766-A1 | ONIUM SALT, RESIST COMPOSITION AND PATTERN FORMING PROCESS | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2023-12-14 | — | — | US | disclosed |
| US-20230400766-A1 | ONIUM SALT, RESIST COMPOSITION AND PATTERN FORMING PROCESS | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2023-12-14 | — | — | US | disclosed |