⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20820945 | 0.80 | — | — | |
| SCHEMBL20215488 | 0.77 | — | — | |
| SCHEMBL19808232 | 0.71 | TSHR (0.37) | — | |
| SCHEMBL20215493 | 0.70 | — | — | |
| SCHEMBL20215431 | 0.70 | — | — | |
| SCHEMBL20820982 | 0.67 | — | — | |
| SCHEMBL20820947 | 0.66 | — | — | |
| SCHEMBL19480413 | 0.66 | — | — | |
| SCHEMBL5613479 | 0.63 | HCAR2 (0.36) | — | |
| SCHEMBL18897983 | 0.62 | — | — |
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-9665002-B2 | Onium salt compound, resist composition, and pattern forming process | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2017-05-30 | — | — | US | disclosed |