⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17580222 | 0.81 | TAAR1 (0.35) | — | |
| SCHEMBL29581622 | 0.81 | TAAR1 (0.35) | — | |
| SCHEMBL9723219 | 0.80 | GABRA1 (0.32) | — | |
| SCHEMBL21634865 | 0.78 | LOXL2 (0.37) | — | |
| SCHEMBL29559941 | 0.78 | NOTUM (0.31) | — | |
| SCHEMBL1425995 | 0.78 | NOTUM (0.31) | — | |
| SCHEMBL419358 | 0.78 | EPAS1 (0.35) | — | |
| SCHEMBL7762549 | 0.77 | GABRA1 (0.39) | — | |
| SCHEMBL16041142 | 0.76 | — | — | |
| SCHEMBL6889220 | 0.75 | CTSL (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007014054-A2 | BENZENESULFONAMIDE INHIBITOR OF CCR2 CHEMOKINE RECEPTOR | GLAXO GROUP LIMTED (GB) | 2007-02-01 | — | — | WO | disclosed |