⚠ 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 | |
|---|---|---|---|---|
| Potassium Ion SCHEMBL572486 | 0.86 | — | — | |
| SCHEMBL7914404 | 0.86 | — | — | |
| SCHEMBL18171066 | 0.86 | — | — | |
| SCHEMBL30288277 | 0.86 | — | — | |
| SCHEMBL18171051 | 0.86 | — | — | |
| Lithium Ion SCHEMBL3886557 | 0.86 | — | — | |
| Sodium Selenocyanate SCHEMBL3898093 | 0.86 | — | — | |
| SCHEMBL18171042 | 0.86 | CA1 (0.86) | — | |
| SCHEMBL18171049 | 0.86 | — | — | |
| SCHEMBL6555795 | 0.86 | CA1 (0.86) | — |
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-9873624-B2 | Methods and systems for selenocyanate removal from contaminated aqueous media | KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) | 2018-01-23 | — | — | US | disclosed |
| US-20160311711-A1 | METHODS AND SYSTEMS FOR SELENOCYANATE REMOVAL FROM CONTAMINATED AQUEOUS MEDIA | KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) | 2016-10-27 | — | — | US | disclosed |