Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | RARB | P10826 | 7/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.40 |
| ▸ | ACACA | Q13085 | 1/20 | 0.40 |
| ▸ | RARA | P10276 | 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 | |
|---|---|---|---|---|
| SCHEMBL9266030 | 0.92 | RARB (0.51) | SMN1; SMN2RAB9ANPC1TP53RARB | |
| SCHEMBL7799497 | 0.91 | RARB (0.55) | SMN1; SMN2RAB9ANPC1RARBAKR1C3 | |
| SCHEMBL7800828 | 0.91 | SMN1; SMN2 (0.43) | SMN1; SMN2RAB9ANPC1TP53RARB | |
| SCHEMBL7799505 | 0.90 | RARB (0.57) | SMN1; SMN2RAB9ANPC1RARBALDH1A1 | |
| SCHEMBL7798294 | 0.89 | RARB (0.46) | SMN1; SMN2RAB9ANPC1TP53RARB | |
| SCHEMBL7789874 | 0.88 | RARB (0.48) | SMN1; SMN2RAB9ANPC1TP53RARB | |
| SCHEMBL8043703 | 0.87 | RARB (0.50) | SMN1; SMN2RAB9ANPC1TP53RARB | |
| SCHEMBL7796724 | 0.86 | PTGS2 (0.49) | SMN1; SMN2RAB9ANPC1TP53RARB | |
| SCHEMBL9267196 | 0.84 | RARB (0.64) | SMN1; SMN2RAB9ANPC1RARBAKR1C3 | |
| SCHEMBL8889150 | 0.83 | AKR1C3 (0.47) | AKR1C3AKR1C2ACACBPPARGL3MBTL1 |
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-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 |
| 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 |