Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29265162 | 0.87 | ALOX5AP (0.36) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| SCHEMBL2135396 | 0.85 | TSHR (0.34) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| SCHEMBL7466903 | 0.81 | AR (0.46) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| SCHEMBL9476261 | 0.79 | PLCG1 (0.35) | ALDH1A1NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL20607680 | 0.79 | NPC1 (0.47) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| SCHEMBL24538043 | 0.76 | HTR7 (0.47) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| SCHEMBL34475296 | 0.76 | HTR7 (0.47) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| SCHEMBL22588118 | 0.76 | ALDH1A1 (0.50) | ALDH1A1KDM4EADRA2BGAA | |
| SCHEMBL10112340 | 0.76 | ALOX5AP (0.35) | — | |
| SCHEMBL29910054 | 0.76 | TSHR (0.36) | ALDH1A1NPC1RAB9AKDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-4630420-A1 | INHIBITORS OF NLRP3 | F. Hoffmann-La Roche AG (CH) | 2025-10-15 | — | — | EP | disclosed |
| WO-2024121184-A1 | INHIBITORS OF NLRP3 | F. HOFFMANN-LA ROCHE AG (CH) | 2024-06-13 | — | — | WO | disclosed |