⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9775068 | 0.81 | ALDH1A1 (0.42) | — | |
| SCHEMBL13348564 | 0.79 | — | — | |
| SCHEMBL20299956 | 0.78 | CA1 (0.39) | — | |
| SCHEMBL5276974 | 0.77 | SMN1; SMN2 (0.46) | — | |
| SCHEMBL27437096 | 0.77 | TSHR (0.42) | — | |
| SCHEMBL7110571 | 0.76 | EPHX1 (0.62) | — | |
| SCHEMBL5638166 | 0.74 | CA1 (0.36) | — | |
| SCHEMBL7198010 | 0.74 | SMN1; SMN2 (0.39) | — | |
| SCHEMBL112203 | 0.74 | ALDH1A1 (0.48) | — | |
| SCHEMBL283731 | 0.74 | ALDH1A1 (0.48) | — |
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-20100137401-A1 | 2-METHYLPROP ANAMIDES AND THEIR USE AS PHARMACEUTICALS | INCYTE CORPORATION (US) | 2010-06-03 | — | — | US | disclosed |
| US-7687665-B2 | 2-(4-Chlorophenyl)-N-[(1R,2R)-2-(benzyloxy)cyclohexyl]-2-methylpropanamide; modulators of 11- beta hydroxyl steroid dehydrogenase type 1 and/or mineralocorticoid receptor | INCYTE CORPORATION (US) | 2010-03-30 | — | — | US | disclosed |