⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16255297 | 0.95 | CNR1 (0.31) | — | |
| SCHEMBL16253295 | 0.86 | CNR1 (0.35) | — | |
| SCHEMBL16253300 | 0.86 | CNR2 (0.31) | — | |
| SCHEMBL16253319 | 0.85 | CNR1 (0.31) | — | |
| SCHEMBL16253317 | 0.85 | — | — | |
| SCHEMBL16253316 | 0.83 | CNR1 (0.38) | — | |
| SCHEMBL16255136 | 0.83 | CNR2 (0.33) | — | |
| SCHEMBL16253314 | 0.83 | — | — | |
| SCHEMBL16253313 | 0.82 | — | — | |
| SCHEMBL16255351 | 0.81 | CNR1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20140343294-A1 | PHARMACEUTICAL COMPOUNDS | KEMOTECH S.R.L. (IT) | 2014-11-20 | — | — | US | disclosed |