Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 4/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | THRA | P10827 | 1/20 | 0.41 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.40 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | APAF1 | O14727 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | RAD52 | P43351 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MYC | P01106 | 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 | |
|---|---|---|---|---|
| SCHEMBL10665776 | 1.00 | S1PR1 (0.43) | S1PR1S1PR3S1PR4S1PR5HTT | |
| SCHEMBL9806810 | 1.00 | S1PR1 (0.43) | S1PR1S1PR3S1PR4S1PR5HTT | |
| SCHEMBL9806788 | 0.93 | MYC (0.38) | S1PR1S1PR3S1PR4S1PR5HTT | |
| SCHEMBL9806848 | 0.92 | THRA (0.44) | S1PR1S1PR3S1PR4S1PR5THRB | |
| SCHEMBL9806824 | 0.92 | THRA (0.44) | S1PR1S1PR3S1PR4S1PR5THRB | |
| SCHEMBL9806866 | 0.91 | ALDH1A1 (0.46) | MEN1KMT2ANPC1SMN1; SMN2MAPT | |
| SCHEMBL9806826 | 0.83 | SMN1; SMN2 (0.44) | S1PR1S1PR3S1PR4HTTTHRB | |
| SCHEMBL10718758 | 0.80 | S1PR1 (0.38) | S1PR1S1PR3S1PR4S1PR5THRB | |
| SCHEMBL9484989 | 0.79 | THRA (0.53) | S1PR1S1PR3S1PR4S1PR5THRB | |
| SCHEMBL9483389 | 0.79 | THRA (0.53) | S1PR1S1PR3S1PR4S1PR5THRB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0244939-B1 | HALOGEN-CONTAINING PYRIDINE COMPOUND AND LIQUID CRYSTAL COMPOSITION | Chisso Corporation (JP) | 1991-04-24 | — | — | EP | disclosed |
| US-4781857-A | SWITCHES, FERROELECTRICITY | CHISSO CORPORATION (JP) | 1988-11-01 | — | — | US | disclosed |
| EP-0244939-A1 | Halogen-containing pyridine compound and liquid crystal composition | Chisso Corporation (JP) | 1987-11-11 | — | — | EP | disclosed |