⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL216478 | 0.91 | — | — | |
| SCHEMBL7397830 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL117292 | 0.86 | — | — | |
| Bromide SCHEMBL29096711 | 0.86 | — | — | |
| SCHEMBL28707904 | 0.86 | — | — | |
| Fluoride SCHEMBL25198266 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL28675739 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL28505760 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL2017739 | 0.82 | — | — | |
| Formic Acid SCHEMBL9075848 | 0.70 | — | — |
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-5932759-A | HYDROLYSIS OF A HYDROXAMIC ACID IN PRESENCE OF A BASE | MITSUI CHEMICALS, INC. (JP) | 1999-08-03 | — | — | US | disclosed |