⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4754969 | 0.79 | CA1 (0.37) | — | |
| SCHEMBL12674670 | 0.74 | — | — | |
| SCHEMBL23033569 | 0.72 | CA1 (0.32) | — | |
| SCHEMBL12667061 | 0.72 | CA1 (0.32) | — | |
| SCHEMBL24405563 | 0.70 | TSHR (0.33) | — | |
| SCHEMBL1008667 | 0.68 | CA1 (0.37) | — | |
| SCHEMBL12674576 | 0.67 | CA1 (0.34) | — | |
| SCHEMBL18574465 | 0.67 | — | — | |
| SCHEMBL18535397 | 0.66 | CA1 (0.33) | — | |
| SCHEMBL6437203 | 0.66 | CA1 (0.35) | — |
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-8808961-B2 | Composition, resist film, pattern forming method, and inkjet recording method | FUJIFILM CORPORATION (JP) | 2014-08-19 | — | — | US | disclosed |