Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7789912 | 1.00 | ALDH1A3 (0.57) | ALDH1A3LMNASIRT2NPC1GAA | |
| SCHEMBL20024678 | 0.85 | ALDH1A3 (0.68) | ALDH1A3LMNASIRT2NPC1GAA | |
| SCHEMBL5536468 | 0.82 | DRD1 (0.50) | ALDH1A3LMNANPC1RAB9AKMT2A | |
| SCHEMBL3124721 | 0.82 | DRD1 (0.50) | ALDH1A3LMNANPC1RAB9AKMT2A | |
| SCHEMBL3124727 | 0.82 | DRD1 (0.50) | ALDH1A3LMNANPC1RAB9AKMT2A | |
| SCHEMBL28733919 | 0.79 | ALDH1A3 (0.61) | ALDH1A3LMNASIRT2NPC1GAA | |
| SCHEMBL8970685 | 0.79 | TAS1R3 (0.40) | ALDH1A3LMNATP53CYP3A4TSHR | |
| SCHEMBL8970691 | 0.79 | TAS1R3 (0.40) | ALDH1A3LMNATP53CYP3A4TSHR | |
| SCHEMBL8741689 | 0.79 | KDM4E (0.46) | LMNANPC1RAB9ASMN1; SMN2KMT2A | |
| SCHEMBL28662974 | 0.79 | KDM4E (0.64) | LMNANPC1RAB9ASMN1; SMN2TP53 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1160242-A1 | Aromatic fatty acid esters | Rolic AG (CH) | 2001-12-05 | — | — | EP | disclosed |
| EP-0546298-B1 | Fatty acids esters containing a pyrimidine ring as component liquid crystalline mixtures | ROLIC AG (CH) | 2000-08-02 | — | — | EP | disclosed |
| EP-0992498-A1 | Aromatic fatty acid esters | Rolic AG (CH) | 2000-04-12 | — | — | EP | disclosed |
| US-5393458-A | Aromatic esters and liquid crystal mixtures containing same | HOFFMANN-LA ROCHE INC. (US) | 1995-02-28 | — | — | US | disclosed |
| US-5326498-A | Electrooptics, ferroelectricity | HOFFMANN-LA ROCHE INC. (US) | 1994-07-05 | — | — | US | disclosed |
| EP-0546298-A2 | Fatty acids esters containing a pyridine or pyrimidine ring as components liquid crystalline mixtures | F. HOFFMANN-LA ROCHE AG (CH) | 1993-06-16 | — | — | EP | disclosed |