⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17814 | 0.94 | — | — | |
| SCHEMBL277607 | 0.94 | — | — | |
| SCHEMBL8099138 | 0.89 | — | — | |
| Phosphine SCHEMBL8099133 | 0.89 | — | — | |
| SCHEMBL8418470 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL8566348 | 0.89 | — | — | |
| Water SCHEMBL2333523 | 0.89 | — | — | |
| SCHEMBL626515 | 0.89 | — | — | |
| SCHEMBL5322544 | 0.89 | — | — | |
| SCHEMBL8574835 | 0.84 | — | — |
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-202447085-U | Stirring reactor | HUBEI XINLANTIAN NEW MATERIALS CO LTD | 2012-09-26 | — | — | CN | disclosed |