⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3468878 | 0.83 | TSHR (0.34) | — | |
| SCHEMBL1193421 | 0.79 | CCNE2 (0.35) | — | |
| SCHEMBL2933753 | 0.78 | HTR1A (0.32) | — | |
| SCHEMBL8490035 | 0.78 | DGAT1 (0.32) | — | |
| SCHEMBL126001 | 0.75 | CYP4F2 (0.42) | — | |
| SCHEMBL2295829 | 0.72 | GAA (0.31) | — | |
| SCHEMBL13698346 | 0.72 | TDP1 (0.45) | — | |
| SCHEMBL3461929 | 0.71 | — | — | |
| SCHEMBL1255383 | 0.70 | TSHR (0.32) | — | |
| SCHEMBL13623133 | 0.70 | TRPA1 (0.41) | — |
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-8772495-B2 | 5-lipoxygenase-activating protein inhibitor | PANMIRA PHARMACEUTICALS, LLC (US) | 2014-07-08 | — | — | US | disclosed |
| US-20090291981-A1 | 5-Lipoxygenase-Activating Protein Inhibitor | AMIRA PHARMACEUTICALS, INC. (US) | 2009-11-26 | — | — | US | disclosed |