Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.35 |
| ▸ | CDK2 | P24941 | 2/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1708612 | 0.85 | SMN1; SMN2 (0.38) | SMN1; SMN2ALDH1A1TP53NPC1RAB9A | |
| SCHEMBL1708299 | 0.85 | FFAR1 (0.42) | SMN1; SMN2ALDH1A1TP53NPC1RAB9A | |
| SCHEMBL1708462 | 0.85 | SMN1; SMN2 (0.37) | SMN1; SMN2ALDH1A1TP53NPC1RAB9A | |
| SCHEMBL1708348 | 0.78 | GAA (0.39) | ALDH1A1LMNAKDM4ECD274MAPT | |
| SCHEMBL1707921 | 0.78 | CD274 (0.34) | NPC1RAB9ACD274PDCD1MAPT | |
| SCHEMBL1708447 | 0.77 | CD274 (0.33) | NPC1RAB9ACD274PDCD1MAPT | |
| SCHEMBL1708296 | 0.77 | CD274 (0.34) | SMN1; SMN2ALDH1A1NPC1RAB9ALMNA | |
| SCHEMBL10291386 | 0.77 | LMNA (0.35) | SMN1; SMN2ALDH1A1TP53NPC1RAB9A | |
| SCHEMBL1708622 | 0.76 | TSHR (0.35) | SMN1; SMN2ALDH1A1NPC1RAB9ALMNA | |
| SCHEMBL1708584 | 0.76 | CD274 (0.41) | CD274PDCD1 |
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-2440541-A1 | NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2012-04-18 | — | — | EP | disclosed |
| WO-2010143733-A1 | NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-12-16 | — | — | WO | disclosed |