⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28989910 | 0.83 | GRIK1 (0.49) | — | |
| SCHEMBL28645703 | 0.83 | GRIK1 (0.49) | — | |
| SCHEMBL28989918 | 0.83 | GRIK1 (0.49) | — | |
| SCHEMBL28641757 | 0.83 | GRIK1 (0.49) | — | |
| SCHEMBL8220494 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL28511729 | 0.81 | — | — | |
| SCHEMBL6118792 | 0.80 | GSR (0.44) | — | |
| Phosphoric Acid SCHEMBL17455469 | 0.78 | LAP3 (0.52) | — | |
| SCHEMBL10777144 | 0.78 | — | — | |
| SCHEMBL8079206 | 0.78 | TSHR (0.40) | — |
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-8828364-B2 | Structured surfactant compositions | RHODIA OPERATIONS (FR) | 2014-09-09 | — | — | US | disclosed |
| US-20080233061-A1 | Alkyl ether sulfate surfactant, alkyl sulfate surfactant, alkanolamide surfactant,amphoteric surfactant, and electrolyte; opacity, yield strength; sodium trideceth sulfate, sodium lauryl sulfate, ammonium lauryl sulfate, sodium lauroamphoacetate, coco monoethanolamide, ammonium chloride, citric acid | SPECIALTY OPERATIONS FRANCE (FR) | 2008-09-25 | — | — | US | disclosed |