⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4642086 | 0.88 | TSHR (0.33) | — | |
| SCHEMBL4643796 | 0.86 | TSHR (0.32) | — | |
| SCHEMBL4645372 | 0.82 | — | — | |
| SCHEMBL4643987 | 0.80 | VCAM1 (0.31) | — | |
| SCHEMBL4646963 | 0.78 | — | — | |
| SCHEMBL4641490 | 0.77 | CAMK2A (0.36) | — | |
| SCHEMBL4641897 | 0.75 | TSHR (0.33) | — | |
| SCHEMBL4647693 | 0.75 | GPR84 (0.37) | — | |
| SCHEMBL4643849 | 0.75 | — | — | |
| SCHEMBL4644909 | 0.75 | TSHR (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1487928-B1 | FILM-FORMING POLYMER AND ANTIFOULING PAINT | JOTUN AS (NO) | 2008-08-13 | — | — | EP | disclosed |