⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27873085 | 0.89 | — | — | |
| Ammonia Solution, Strong SCHEMBL8566905 | 0.80 | — | — | |
| SCHEMBL27714173 | 0.80 | — | — | |
| SCHEMBL5157652 | 0.80 | — | — | |
| Water SCHEMBL28094136 | 0.80 | — | — | |
| SCHEMBL1178591 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL8567000 | 0.78 | — | — | |
| SCHEMBL8353125 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL11344224 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL4025141 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5840338-A | THERMAL AND CHEMICAL STABILITY | MEDLOGIC GLOBAL LIMITED (GB) | 1998-11-24 | — | — | US | disclosed |
| US-5603955-A | GEL NETWORK; PROTECTIVE POLYMER; PROTECTANT SALT | UNIVERSITY OF CINCINNATI (US) | 1997-02-18 | — | — | US | disclosed |