⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10039989 | 0.82 | — | — | |
| (Dimethylamino)Methyl(Methyl)Phosphinic Acid SCHEMBL13979830 | 0.73 | — | — | |
| SCHEMBL9814035 | 0.68 | TSHR (0.47) | — | |
| SCHEMBL17488950 | 0.67 | — | — | |
| SCHEMBL10000458 | 0.67 | USP2 (0.36) | — | |
| Dimethylformamide SCHEMBL6241404 | 0.66 | TSHR (0.64) | — | |
| SCHEMBL209008 | 0.65 | — | — | |
| SCHEMBL82537 | 0.64 | — | — | |
| Dimethylformamide SCHEMBL27791385 | 0.64 | TSHR (0.60) | — | |
| Dimethylformamide SCHEMBL27212545 | 0.64 | TSHR (0.60) | — |
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-20120028926-A1 | Phosphate Management with Small Molecules | CYTOCHROMA INC. (CA) | 2012-02-02 | — | — | US | disclosed |