⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8023240 | 0.81 | CNR2 (0.33) | — | |
| SCHEMBL24571680 | 0.81 | ALDH1A1 (0.39) | — | |
| SCHEMBL4813099 | 0.78 | — | — | |
| SCHEMBL1233980 | 0.78 | — | — | |
| SCHEMBL7771893 | 0.77 | TSHR (0.32) | — | |
| SCHEMBL19413955 | 0.77 | FAAH (0.48) | — | |
| SCHEMBL19413998 | 0.77 | FAAH (0.48) | — | |
| SCHEMBL26087113 | 0.75 | — | — | |
| SCHEMBL5266553 | 0.75 | CA1 (0.32) | — | |
| SCHEMBL4813103 | 0.74 | TSHR (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-7320986-B2 | Fused tri and tetra-cyclic pyrazole kinase inhibitors | ABBOTT LABORTORIES (US) | 2008-01-22 | — | — | US | disclosed |
| US-20040259904-A1 | Fused tri and tetra-cyclic pyrazole kinase inhibitors | ABBVIE INC. | 2004-12-23 | — | — | US | disclosed |