Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPG | Q9Y5X9 | 13/20 | 0.65 |
| ▸ | LPL | P06858 | 12/20 | 0.65 |
| ▸ | CA1 | P00915 | 4/20 | 0.42 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | CA9 | Q16790 | 4/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | F11 | P03951 | 2/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.39 |
| ▸ | SNCA | P37840 | 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 | |
|---|---|---|---|---|
| SCHEMBL26371403 | 0.87 | LIPG (0.57) | LIPGLPLCA1CA2CA9 | |
| SCHEMBL26371387 | 0.83 | LPL (0.47) | LIPGLPLCA1CA2CA9 | |
| SCHEMBL59540 | 0.83 | LPL (0.47) | LIPGLPLCA1CA2CA9 | |
| SCHEMBL12681706 | 0.82 | LIPG (0.74) | LIPGLPLCA1CA2CA9 | |
| SCHEMBL24608995 | 0.80 | LIPG (0.83) | LIPGLPLCA1CA2CA9 | |
| SCHEMBL2707320 | 0.80 | LIPG (0.83) | LIPGLPLCA1CA2CA9 | |
| SCHEMBL792244 | 0.79 | LIPG (1.00) | LIPGLPLCA1CA2CA9 | |
| SCHEMBL59080 | 0.76 | LPL (0.53) | LIPGLPLCA1CA2CA9 | |
| SCHEMBL18270358 | 0.76 | LIPG (0.89) | LIPGLPLCA1CA2CA9 | |
| SCHEMBL18270355 | 0.76 | LIPG (0.89) | LIPGLPLCA1CA2CA9 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230392075-A1 | AROMATIC ISOTHIOCYANATES | MERCK PATENT GMBH (DE) | 2023-12-07 | — | — | US | disclosed |
| EP-4237509-A1 | AROMATIC ISOTHIOCYANATES | Merck Patent GmbH (DE) | 2023-09-06 | — | — | EP | disclosed |
| CN-116490591-A | Aromatic isothiocyanates | 默克专利股份有限公司 | 2023-07-25 | — | — | CN | disclosed |
| WO-2022090109-A1 | AROMATIC ISOTHIOCYANATES | MERCK PATENT GMBH (DE) | 2022-05-05 | — | — | WO | disclosed |
| WO-2022090109-A1 | AROMATIC ISOTHIOCYANATES | MERCK PATENT GMBH (DE) | 2022-05-05 | — | — | WO | disclosed |