Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | S100B | P04271 | 1/20 | 0.38 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | TERT | O14746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 7/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6875549 | 0.86 | ALDH1A1 (0.61) | ALDH1A1CYP3A4S100BLMNATDP1 | |
| SCHEMBL20312800 | 0.84 | S100B (0.45) | ALDH1A1CYP3A4BLMS100BLMNA | |
| SCHEMBL11126424 | 0.84 | ALDH1A1 (0.48) | ALDH1A1CYP3A4BLMS100BLMNA | |
| SCHEMBL10344852 | 0.81 | ALDH1A1 (0.48) | ALDH1A1CYP3A4BLMHCAR1TSHR | |
| SCHEMBL10345226 | 0.80 | ALDH1A1 (0.43) | ALDH1A1CYP3A4LMNAKDM4EGAA | |
| SCHEMBL7739116 | 0.77 | PTGS2 (0.46) | ALDH1A1CYP3A4LMNATDP1TSHR | |
| Formaldehyde SCHEMBL9774290 | 0.77 | ALDH1A1 (0.72) | ALDH1A1CYP3A4BLMS100BLMNA | |
| SCHEMBL3234447 | 0.75 | ALDH1A1 (0.57) | ALDH1A1HCAR1TSHRPTGS2ACHE | |
| SCHEMBL20312820 | 0.74 | S100B (0.38) | ALDH1A1CYP3A4BLMS100BTDP1 | |
| Orcinol SCHEMBL11446817 | 0.73 | ALDH1A1 (0.71) | ALDH1A1CYP3A4HCAR1GAAMEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0144195-B1 | SQUARAINE COMPOSITIONS | XEROX CORPORATION (US) | 1990-04-11 | — | — | EP | disclosed |
| US-4552822-A | Photoconductive devices with hydroxy containing squaraine compositions | XEROX CORPORATION (US) | 1985-11-12 | — | — | US | disclosed |
| US-4524218-A | FROM SQUARIC ACID AN AROMATIC AMINE, AND A PHENOL OR PHENOL SWUARINE | XEROX CORPORATION (US) | 1985-06-18 | — | — | US | disclosed |
| EP-0144195-A2 | Squaraine compositions | XEROX CORPORATION (US) | 1985-06-12 | — | — | EP | disclosed |