⚠ 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 | |
|---|---|---|---|---|
| Fluoride Ion SCHEMBL23200399 | 0.83 | — | — | |
| SCHEMBL444758 | 0.82 | — | — | |
| SCHEMBL14721708 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL9317182 | 0.73 | — | — | |
| SCHEMBL3133499 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL10488807 | 0.73 | — | — | |
| SCHEMBL2044940 | 0.73 | — | — | |
| Helium SCHEMBL7068545 | 0.73 | — | — | |
| Water SCHEMBL2687435 | 0.73 | — | — | |
| SCHEMBL729481 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-8092599-A | — | — | None | — | — | JP | disclosed |
| JP-H0892599-A | CLEANING LIQUID | I N G:KK | 1996-04-09 | — | — | JP | disclosed |