Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRC | Q99895 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.46 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.43 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | PLA2G2D | Q9UNK4 | 1/20 | 0.43 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.42 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9809647 | 0.86 | CTRC (0.47) | CTRCMAOBPTPN11LTB4RLTB4R2 | |
| SCHEMBL9809646 | 0.86 | CTRC (0.47) | CTRCMAOBPTPN11LTB4RLTB4R2 | |
| SCHEMBL9224875 | 0.80 | PPARA (0.46) | ALDH1A1 | |
| SCHEMBL4819103 | 0.78 | MAOB (0.59) | MAOBLTB4RLTB4R2ALDH1A1MCL1 | |
| SCHEMBL1257328 | 0.78 | ALDH1A1 (0.55) | PTPN11ALDH1A1 | |
| SCHEMBL7909000 | 0.77 | MAOB (0.58) | MAOBPTPN11LTB4RLTB4R2ALDH1A1 | |
| SCHEMBL13965403 | 0.77 | CTRC (0.46) | CTRCMAOBPTPN11ALDH1A1MCL1 | |
| SCHEMBL22438999 | 0.76 | PTPN11 (0.62) | MAOBPTPN11MCL1 | |
| SCHEMBL22438896 | 0.76 | PTPN11 (0.62) | MAOBPTPN11MCL1 | |
| Lithium Ion SCHEMBL29695998 | 0.76 | MAOB (0.57) | MAOBLTB4RLTB4R2ALDH1A1MCL1 |
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-0422996-B1 | Liquid crystal compound | SHOWA SHELL SEKIYU (JP) | 1995-04-12 | — | — | EP | disclosed |
| US-5328641-A | Naphthalene ester derivatives with trifluoromethyl groups | SHOWA SHELL SEKIYU KABUSHIKI KAISHA | 1994-07-12 | — | — | US | disclosed |
| US-5207947-A | Trifluoroalkyl diaryl triesters; antiferroelectricity; electrooptics | SHOWA SHELL SEKIYU KABUSHIKI KAISHA (JP) | 1993-05-04 | — | — | US | disclosed |
| EP-0422996-A2 | Liquid crystal compound | Showa Shell Sekiyu Kabushiki Kaisha (JP) | 1991-04-17 | — | — | EP | disclosed |