⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9769566 | 0.76 | — | — | |
| SCHEMBL8157463 | 0.75 | PIK3CD (0.31) | — | |
| SCHEMBL35372 | 0.74 | KMT2A (0.34) | — | |
| SCHEMBL35708 | 0.74 | HRH3 (0.33) | — | |
| SCHEMBL35707 | 0.74 | HRH3 (0.33) | — | |
| SCHEMBL35373 | 0.74 | KMT2A (0.34) | — | |
| Water SCHEMBL23403854 | 0.72 | HRH3 (0.32) | — | |
| Water SCHEMBL17501713 | 0.72 | HRH3 (0.32) | — | |
| SCHEMBL1513979 | 0.68 | — | — | |
| SCHEMBL14486746 | 0.68 | — | — |
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-20040013965-A1 | Sensitivity enhancement of radiation-sensitive elements | CREO INC. (CA) | 2004-01-22 | — | — | US | disclosed |