⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27857243 | 0.80 | — | — | |
| SCHEMBL27475624 | 0.72 | — | — | |
| SCHEMBL27490919 | 0.71 | CACNA1G (0.31) | — | |
| SCHEMBL27669595 | 0.70 | ALDH1A1 (0.35) | — | |
| SCHEMBL27857220 | 0.70 | HTR2C (0.33) | — | |
| SCHEMBL28924670 | 0.69 | CACNA1G (0.34) | — | |
| SCHEMBL27813729 | 0.67 | NOS3 (0.36) | — | |
| SCHEMBL27432961 | 0.65 | CACNA1G (0.32) | — | |
| SCHEMBL27881629 | 0.63 | CACNA1G (0.36) | — | |
| SCHEMBL18659117 | 0.62 | NSD2 (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 |
|---|---|---|---|---|---|---|---|
| CN-102325753-A | Carbazole carboxamide compounds useful as kinase inhibitors | BRISTOL MYERS SQUIBB CO | 2012-01-18 | — | — | CN | disclosed |