Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10514412 | 0.68 | CHRNB2 (0.40) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL4867153 | 0.67 | KDM4E (0.63) | KIF11RIPK1CYP2D6L3MBTL1PROKR1 | |
| SCHEMBL4865006 | 0.64 | NPC1 (0.52) | NPC1HPGDRAB9ANPSR1TP53 | |
| SCHEMBL20580237 | 0.64 | RIPK1 (0.41) | KIF11GAARIPK1NPSR1CHRNB2 | |
| SCHEMBL28873176 | 0.64 | RIPK1 (0.41) | KIF11GAARIPK1NPSR1CHRNB2 | |
| SCHEMBL21425147 | 0.63 | RIPK1 (0.61) | RIPK1CHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL8563605 | 0.63 | NOTUM (0.69) | ALDH1A1HPGDNPSR1MEN1KMT2A | |
| SCHEMBL19659716 | 0.62 | RIPK1 (0.36) | RIPK1CYP2D6CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL22225173 | 0.61 | RIPK1 (0.37) | RIPK1NPC1RAB9AHRH3MEN1 | |
| Dimethylcarbate SCHEMBL8440752 | 0.61 | AKR1C3 (0.53) | NPC1ALDH1A1RAB9AHRH3KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4334289-A1 | NOVEL HETEROCYCLIC COMPOUNDS, COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF | Organon R&D Finland Ltd (FI) | 2024-03-13 | — | — | EP | disclosed |