⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2491442 | 0.74 | — | — | |
| SCHEMBL24769051 | 0.74 | — | — | |
| SCHEMBL13614228 | 0.74 | — | — | |
| SCHEMBL24769050 | 0.74 | — | — | |
| SCHEMBL32671453 | 0.73 | HIF1A (0.39) | — | |
| SCHEMBL1148827 | 0.72 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL32680543 | 0.72 | APLNR (0.33) | — | |
| SCHEMBL32680531 | 0.72 | SIGMAR1 (0.38) | — | |
| SCHEMBL21903 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL32680524 | 0.70 | SIGMAR1 (0.37) | — |
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-86100630-A | Preparation contains the method for the sterilant of acylurea | — | 1986-09-03 | — | — | CN | disclosed |