⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7869369 | 0.88 | TSHR (0.30) | — | |
| SCHEMBL15014411 | 0.77 | TSHR (0.30) | — | |
| SCHEMBL13650115 | 0.77 | TSHR (0.30) | — | |
| SCHEMBL15999684 | 0.76 | — | — | |
| SCHEMBL1001553 | 0.76 | — | — | |
| SCHEMBL13757310 | 0.74 | — | — | |
| SCHEMBL18073190 | 0.74 | — | — | |
| SCHEMBL16790490 | 0.74 | — | — | |
| SCHEMBL7870986 | 0.73 | — | — | |
| SCHEMBL13951272 | 0.73 | — | — |
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-20100078787-A1 | SEMICONDUCTOR DEVICE | SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) | 2010-04-01 | — | — | US | disclosed |