⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27758685 | 0.84 | — | — | |
| Bromide SCHEMBL28272603 | 0.82 | — | — | |
| Bromide SCHEMBL28096066 | 0.75 | — | — | |
| SCHEMBL5680558 | 0.69 | — | — | |
| SCHEMBL27354844 | 0.66 | — | — | |
| SCHEMBL24717329 | 0.65 | — | — | |
| SCHEMBL10755135 | 0.62 | — | — | |
| SCHEMBL15201601 | 0.58 | — | — | |
| SCHEMBL4357637 | 0.45 | — | — | |
| SCHEMBL11264365 | 0.45 | — | — |
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-86102906-A | Preparation 1, the method for the two substituted imidazole salt of 3- | — | 1987-02-11 | — | — | CN | disclosed |