Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Benzenethiol SCHEMBL19712996 | 0.88 | ALDH1A1 (0.77) | ALDH1A1HSD17B10L3MBTL1SMN1; SMN2CYP3A4 | |
| SCHEMBL6480845 | 0.87 | ALDH1A1 (0.83) | ALDH1A1HSD17B10L3MBTL1SMN1; SMN2CYP3A4 | |
| SCHEMBL31264295 | 0.85 | ALDH1A1 (0.79) | ALDH1A1HSD17B10L3MBTL1SMN1; SMN2CYP3A4 | |
| SCHEMBL13437596 | 0.82 | ALDH1A1 (0.43) | ALDH1A1HSD17B10L3MBTL1SMN1; SMN2CYP3A4 | |
| SCHEMBL30170547 | 0.82 | ABL1 (0.42) | ALDH1A1HSD17B10HPGDIDO1 | |
| SCHEMBL599657 | 0.80 | ALDH1A1 (0.71) | ALDH1A1HSD17B10L3MBTL1SMN1; SMN2CYP3A4 | |
| SCHEMBL29510158 | 0.80 | ALDH1A1 (0.71) | ALDH1A1HSD17B10L3MBTL1SMN1; SMN2CYP3A4 | |
| SCHEMBL712916 | 0.80 | ALDH1A1 (0.90) | ALDH1A1HSD17B10L3MBTL1SMN1; SMN2CYP3A4 | |
| SCHEMBL25981 | 0.79 | ALDH1A1 (1.00) | ALDH1A1HSD17B10L3MBTL1SMN1; SMN2CYP3A4 | |
| SCHEMBL28465796 | 0.79 | ALDH1A1 (1.00) | ALDH1A1HSD17B10L3MBTL1SMN1; SMN2CYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023149761-A1 | ORGANIC MOLECULES USABLE IN OPTOELECTRONIC DEVICES | SAMSUNG DISPLAY CO., LTD. (KR) | 2023-08-10 | — | — | WO | disclosed |