Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 6/20 | 0.41 |
| ▸ | THRB | P10828 | 6/20 | 0.41 |
| ▸ | HMGCR | P04035 | 3/20 | 0.38 |
| ▸ | GGPS1 | O95749 | 4/20 | 0.37 |
| ▸ | FDPS | P14324 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | GSR | P00390 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7519057 | 0.85 | GSR (0.49) | THRATHRBHMGCRFDPSGSR | |
| SCHEMBL7080284 | 0.82 | HMGCR (0.60) | HMGCR | |
| SCHEMBL12605071 | 0.75 | THRA (0.40) | THRATHRBHMGCRTSHRRORC | |
| SCHEMBL2858256 | 0.75 | TSHR (0.47) | THRATHRBTSHRRORCGSR | |
| SCHEMBL9266942 | 0.73 | TSHR (0.45) | THRATHRBTSHRRORCGSR | |
| SCHEMBL27415462 | 0.73 | HMGCR (0.47) | THRATHRBHMGCRGSR | |
| SCHEMBL13815916 | 0.72 | EGFR (0.38) | THRATHRBHMGCRTSHRRORC | |
| SCHEMBL10545170 | 0.72 | TSHR (0.44) | TSHRRORCGSR | |
| SCHEMBL10946690 | 0.70 | CA1 (0.58) | TSHRRORCGSR | |
| SCHEMBL6370947 | 0.70 | HMGCR (0.66) | HMGCRTSHRGSR |
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-0845991-B1 | USE OF PHENOL SUBSTITUTED DIPHOSPHONATES AS ANTINEOPLASTIC AGENTS | SYMPHAR SA (CH) | 2002-02-06 | — | — | EP | claimed |
| JP-2022285-A | — | — | None | — | — | JP | disclosed |
| JP-H0222285-A | PHENOL SUBSTITUTED GEM-DIPHOSPHONATE DERIVATIVE, ITS PREPARATION AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | SYMPHAR SA | 1990-01-25 | — | — | JP | disclosed |