Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 4/20 | 0.40 |
| ▸ | CNR1 | P21554 | 4/20 | 0.38 |
| ▸ | CNR2 | P34972 | 4/20 | 0.38 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ACAT1 | P24752 | 1/20 | 0.35 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22748595 | 1.00 | MGLL (0.40) | MGLLCNR1CNR2PLA2G4ATLR8 | |
| SCHEMBL22748742 | 1.00 | MGLL (0.40) | MGLLCNR1CNR2PLA2G4ATLR8 | |
| SCHEMBL22748736 | 1.00 | MGLL (0.40) | MGLLCNR1CNR2PLA2G4ATLR8 | |
| SCHEMBL22748589 | 0.89 | CNR1 (0.40) | MGLLCNR1CNR2PLA2G4ATLR8 | |
| SCHEMBL22748673 | 0.89 | CNR1 (0.40) | MGLLCNR1CNR2PLA2G4ATLR8 | |
| SCHEMBL22748584 | 0.86 | MGLL (0.39) | MGLLCNR1CNR2PLA2G4ATLR8 | |
| SCHEMBL22748670 | 0.86 | MGLL (0.39) | MGLLCNR1CNR2PLA2G4ATLR8 | |
| SCHEMBL22748568 | 0.85 | PLA2G4A (0.47) | CNR1PLA2G4ATP53MAPTTSHR | |
| SCHEMBL22748632 | 0.85 | PLA2G4A (0.47) | CNR1PLA2G4ATP53MAPTTSHR | |
| SCHEMBL22748990 | 0.85 | PLA2G4A (0.47) | CNR1PLA2G4ATP53MAPTTSHR |
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-2020245291-A1 | PYRROLE DERIVATIVES AS ACC INHIBITORS | ALMIRALL, S.A. (ES) | 2020-12-10 | — | — | WO | disclosed |