⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21301 | 0.89 | — | — | |
| SCHEMBL8863961 | 0.86 | — | — | |
| Charcoal, Activated SCHEMBL30400894 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL10839055 | 0.86 | — | — | |
| SCHEMBL5466451 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL15969117 | 0.86 | — | — | |
| Ethylene SCHEMBL17838321 | 0.86 | — | — | |
| SCHEMBL4877528 | 0.80 | — | — | |
| SCHEMBL758054 | 0.80 | — | — | |
| Acetic Acid SCHEMBL5180440 | 0.79 | — | — |
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-5507914-A | MIXING IN A CELLULASES IN VERTICAL TANK, THEN MIXING IN WATER A WATER SOLUBLE CATIONIC AND ANIONIC POLYMERS | NALCO CHEMICAL COMPANY (US) | 1996-04-16 | — | — | US | claimed |
| US-5507914-A | MIXING IN A CELLULASES IN VERTICAL TANK, THEN MIXING IN WATER A WATER SOLUBLE CATIONIC AND ANIONIC POLYMERS | NALCO CHEMICAL COMPANY (US) | 1996-04-16 | — | — | US | disclosed |