Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 2/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 13/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 13/20 | 0.40 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8768280 | 1.00 | XDH (0.44) | XDHCYP11B1CYP11B2KCNJ1KDM1A | |
| SCHEMBL8768454 | 0.99 | XDH (0.45) | XDHCYP11B1CYP11B2KCNJ1KDM1A | |
| SCHEMBL10651895 | 0.86 | CYP11B1 (0.40) | XDHCYP11B1CYP11B2KCNJ1KDM1A | |
| SCHEMBL10651903 | 0.86 | CYP11B1 (0.40) | XDHCYP11B1CYP11B2KCNJ1KDM1A | |
| SCHEMBL8767155 | 0.86 | RARB (0.37) | XDH | |
| SCHEMBL8767859 | 0.86 | RARB (0.37) | XDH | |
| SCHEMBL8768327 | 0.86 | RARB (0.37) | XDH | |
| SCHEMBL10646905 | 0.85 | CYP11B1 (0.41) | XDHCYP11B1CYP11B2KCNJ1KDM1A | |
| SCHEMBL10646911 | 0.85 | CYP11B1 (0.41) | XDHCYP11B1CYP11B2KCNJ1KDM1A | |
| SCHEMBL8767577 | 0.85 | TDP1 (0.37) | XDH |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1168365-A | Cyclopentyl derivatives | ROLIC AG (CH) | 1997-12-24 | — | — | CN | disclosed |
| EP-0789067-A1 | Cyclopentyl derivatives useful as liquid crystals | Rolic AG (CH) | 1997-08-13 | — | — | EP | disclosed |