⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2915566 | 0.79 | NPC1 (1.00) | — | |
| SCHEMBL18240065 | 0.79 | NPC1 (1.00) | — | |
| SCHEMBL30538675 | 0.79 | NPC1 (1.00) | — | |
| SCHEMBL10518811 | 0.79 | GAA (0.68) | — | |
| SCHEMBL1389297 | 0.79 | NPC1 (1.00) | — | |
| SCHEMBL15221662 | 0.78 | L3MBTL1 (0.75) | — | |
| SCHEMBL8058911 | 0.78 | L3MBTL1 (0.75) | — | |
| Hydrochloric Acid SCHEMBL11748662 | 0.77 | NPC1 (0.94) | — | |
| SCHEMBL4541765 | 0.74 | — | — | |
| SCHEMBL143318 | 0.74 | — | — |
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-20090068169-A1 | 2,4,6-triamino-s-triazine-based compounds which bind to the tail (fc) portion of immunoglobulins and their use | PROMETIC BIOSCIENCES INC. (CA) | 2009-03-12 | — | — | US | disclosed |