⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10903147 | 0.82 | — | — | |
| SCHEMBL9446891 | 0.80 | — | — | |
| SCHEMBL28682297 | 0.76 | — | — | |
| SCHEMBL8823392 | 0.76 | TSHR (0.48) | — | |
| SCHEMBL8823395 | 0.76 | TSHR (0.48) | — | |
| SCHEMBL7597961 | 0.75 | TSHR (0.38) | — | |
| SCHEMBL15353 | 0.74 | — | — | |
| SCHEMBL12973059 | 0.74 | — | — | |
| SCHEMBL15352 | 0.74 | — | — | |
| SCHEMBL23659094 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1048606-A | Has the sensitization static negative that contains leuco dye that prints off image | DU PONT (US) | 1991-01-16 | — | — | CN | disclosed |