Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 5/20 | 0.33 |
| ▸ | CNR1 | P21554 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL13683400 | 0.78 | HTT (0.35) | CNR2CNR1HTT | |
| SCHEMBL24547514 | 0.76 | CNR1 (0.34) | CNR2CNR1 | |
| SCHEMBL21574233 | 0.74 | HTT (0.35) | CNR2KDM4EHTT | |
| SCHEMBL18433509 | 0.73 | CNR2 (0.38) | CNR2CNR1KDM4E | |
| SCHEMBL24085856 | 0.73 | PIK3CD (0.40) | CNR2CNR1KDM4EHTTNPC1 | |
| SCHEMBL15332441 | 0.71 | — | — | |
| SCHEMBL13001490 | 0.70 | CNR2 (0.39) | CNR2CNR1HTT | |
| SCHEMBL10059147 | 0.69 | PIK3CD (0.34) | CNR2CNR1KDM4EHTT | |
| SCHEMBL5986972 | 0.68 | HTT (0.38) | KDM4EHTT | |
| SCHEMBL18433366 | 0.67 | KDM4E (0.34) | CNR2CNR1KDM4E |
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-2022129331-A1 | MACROCYCLIC BRANCHED 3-FLUORO-BUT-3-ENAMIDES AS INHIBITORS OF MCL-1 | JANSSEN PHARMACEUTICA NV (BE) | 2022-06-23 | — | — | WO | disclosed |