Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 6/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.32 |
| ▸ | AR | P10275 | 2/20 | 0.30 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8999924 | 0.84 | CYP19A1 (0.38) | CYP19A1NR3C1ARPGRNR3C2 | |
| SCHEMBL8999956 | 0.78 | CYP19A1 (0.38) | CYP19A1NR3C1ARPGRNR3C2 | |
| SCHEMBL8999935 | 0.77 | CYP19A1 (0.36) | CYP19A1 | |
| SCHEMBL8999916 | 0.76 | CYP19A1 (0.38) | CYP19A1 | |
| SCHEMBL8999971 | 0.66 | CYP19A1 (0.47) | CYP19A1NR3C1 | |
| SCHEMBL8999974 | 0.66 | CYP19A1 (0.47) | CYP19A1NR3C1 | |
| SCHEMBL9000008 | 0.64 | CYP19A1 (0.49) | CYP19A1 | |
| SCHEMBL10529661 | 0.62 | CYP19A1 (0.38) | CYP19A1NR3C1 | |
| SCHEMBL10529663 | 0.62 | CYP19A1 (0.38) | CYP19A1NR3C1 | |
| SCHEMBL9470387 | 0.61 | ESR1 (0.46) | CYP19A1NR3C1ARPGRNR3C2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0515264-B1 | New steroid derivatives of pregna-4,9(11),17(20)-trien-3-on, their preparation, their use in the preparation of derivatives of pregna-4,9(11),16-trien-3,20-dione and intermediates therefor | ROUSSEL UCLAF (FR) | 1996-09-11 | — | — | EP | disclosed |
| EP-0515264-A2 | New steroid derivatives of pregna-4,9(11),17(20)-trien-3-on, their preparation, their use in the preparation of derivatives of pregna-4,9(11),16-trien-3,20-dione and intermediates therefor | ROUSSEL UCLAF (FR) | 1992-11-25 | — | — | EP | disclosed |