Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.62 |
| ▸ | MAPT | P10636 | 7/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.62 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.62 |
| ▸ | HPGD | P15428 | 2/20 | 0.62 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 9/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 9/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | GRM5 | P41594 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MITF | O75030 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CASP6 | P55212 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3922311 | 0.91 | ALDH1A1 (0.67) | ALDH1A1MAPTSMN1; SMN2KDM4ELMNA | |
| SCHEMBL3928773 | 0.86 | ALDH1A1 (0.66) | ALDH1A1MAPTSMN1; SMN2KDM4ELMNA | |
| SCHEMBL3420914 | 0.78 | ALDH1A1 (0.62) | ALDH1A1MAPTSMN1; SMN2KDM4ELMNA | |
| SCHEMBL3421825 | 0.76 | ALDH1A1 (0.77) | ALDH1A1MAPTSMN1; SMN2KDM4ELMNA | |
| SCHEMBL3420588 | 0.75 | ALDH1A1 (0.66) | ALDH1A1MAPTSMN1; SMN2KDM4ELMNA | |
| SCHEMBL13337747 | 0.75 | ALDH1A1 (0.63) | ALDH1A1MAPTSMN1; SMN2KDM4ELMNA | |
| SCHEMBL3418028 | 0.75 | ALDH1A1 (0.78) | ALDH1A1MAPTSMN1; SMN2KDM4ELMNA | |
| SCHEMBL3929125 | 0.75 | ALDH1A1 (0.54) | ALDH1A1MAPTSMN1; SMN2KDM4ELMNA | |
| SCHEMBL3422755 | 0.75 | L3MBTL1 (0.62) | ALDH1A1MAPTSMN1; SMN2KDM4ELMNA | |
| SCHEMBL3421903 | 0.75 | ALDH1A1 (0.62) | ALDH1A1MAPTSMN1; SMN2KDM4ELMNA |
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-1756118-B1 | TETRAHYDROPYRIDOTHIOPHENES FOR USE IN THE TREATMENT OF CANCER | NYCOMED GMBH (DE) | 2008-05-28 | — | — | EP | disclosed |