⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5157470 | 0.85 | CDK1 (0.38) | — | |
| SCHEMBL8854656 | 0.81 | HSD17B10 (0.35) | — | |
| SCHEMBL9504245 | 0.77 | MAPT (0.32) | — | |
| SCHEMBL313536 | 0.74 | MAPT (0.37) | — | |
| SCHEMBL6754313 | 0.74 | KCNH3 (0.46) | — | |
| SCHEMBL4630093 | 0.74 | TLR8 (0.31) | — | |
| SCHEMBL5792612 | 0.72 | CDK1 (0.32) | — | |
| SCHEMBL11551962 | 0.72 | KCNH3 (0.51) | — | |
| SCHEMBL8379018 | 0.71 | KCNH3 (0.35) | — | |
| SCHEMBL4452232 | 0.70 | CDK1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7144681-B2 | Heat-sensitive composition in which removal of the unexposed regions is unnecessary, negative lithographic plate coated with the said composition and method for forming a negative image on the said plate | LASTRA S.P.A. (IT) | 2006-12-05 | — | — | US | disclosed |
| US-20050238995-A1 | Heat-sensitive composition in which removal of the unexposed regions is unnecessary, negative lithographic plate coated with the said composition and method for forming a negative image on the said plate | LASTRA S.P.A. | 2005-10-27 | — | — | US | disclosed |