Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9800177 | 0.78 | SMN1; SMN2 (0.42) | TP53GAASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL1512608 | 0.78 | TP53 (0.41) | TP53GAASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL10636223 | 0.77 | ESR2 (0.44) | ESR2GAAL3MBTL1ALDH1A1NPC1 | |
| SCHEMBL28900963 | 0.76 | TP53 (0.40) | ESR2TP53GAASMN1; SMN2ALDH1A1 | |
| SCHEMBL791232 | 0.72 | BRD4 (0.46) | TP53GAASMN1; SMN2ALDH1A1BRD4 | |
| SCHEMBL1950227 | 0.71 | TLR4 (0.43) | ESR2GAAALDH1A1 | |
| SCHEMBL3879955 | 0.71 | TP53 (0.44) | TP53GAASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL2200767 | 0.71 | TP53 (0.56) | TP53GAASMN1; SMN2ALDH1A1BRD4 | |
| SCHEMBL244740 | 0.71 | — | — | |
| SCHEMBL2948892 | 0.71 | TP53 (0.56) | TP53GAASMN1; SMN2ALDH1A1BRD4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0270843-B1 | 4-HYDROXY-4-(SUBSTITUTED ALKENYL)-CYCLOHEXANE CARBOXYLIC ACID | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-03-06 | — | — | EP | disclosed |
| EP-0270843-A1 | 4-Hydroxy-4-(substituted alkenyl)-cyclohexane carboxylic acid | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-06-15 | — | — | EP | disclosed |
| US-4748274-A | LEUKOTRIENE ANTAGONIST | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-05-31 | — | — | US | disclosed |