Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | RARA | P10276 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | RARG | P13631 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | SCD | O00767 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 3/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8077225 | 0.87 | HSD17B1 (0.35) | ALDH1A1KDM4ESMN1; SMN2NPC1MAPT | |
| SCHEMBL8084285 | 0.87 | RAB9A (0.39) | ALDH1A1KDM4ESMN1; SMN2NPC1CYP1A2 | |
| SCHEMBL8084362 | 0.86 | KDM4E (0.34) | ALDH1A1KDM4ESMN1; SMN2NPC1MAPT | |
| SCHEMBL8088427 | 0.83 | MAPT (0.33) | ALDH1A1KDM4EMAPT | |
| SCHEMBL8090525 | 0.83 | ALDH1A1 (0.46) | ALDH1A1MAPTUSP2KMT2AMEN1 | |
| SCHEMBL10697007 | 0.80 | RARA (0.38) | ALDH1A1KDM4ESMN1; SMN2MAPTRARA | |
| SCHEMBL8085151 | 0.79 | MAPT (0.34) | ALDH1A1KDM4EMAPT | |
| SCHEMBL8085086 | 0.79 | MALT1 (0.35) | KDM4ECYP1A2CYP2C9CYP2C19MAPT | |
| SCHEMBL8077028 | 0.78 | CA9 (0.35) | ALDH1A1NPC1MAPTKMT2AMEN1 | |
| SCHEMBL8088434 | 0.73 | S100A4 (0.37) | ALDH1A1KDM4ESMN1; SMN2NPC1MAPT |
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-0340718-A1 | Chroman derivatives | MERCK PATENT GmbH (DE) | 1989-11-08 | — | — | EP | disclosed |