Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 9/20 | 0.86 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.86 |
| ▸ | PGR | P06401 | 5/20 | 0.86 |
| ▸ | USP2 | O75604 | 5/20 | 0.86 |
| ▸ | LMNA | P02545 | 2/20 | 0.86 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.86 |
| ▸ | MAPT | P10636 | 2/20 | 0.86 |
| ▸ | MLNR | O43193 | 1/20 | 0.86 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.86 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.86 |
| ▸ | PPARG | P37231 | 1/20 | 0.86 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.86 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.86 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.86 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.86 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.85 |
| ▸ | DRD2 | P14416 | 1/20 | 0.85 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.85 |
| ▸ | MEN1 | O00255 | 1/20 | 0.76 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.76 |
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 | |
|---|---|---|---|---|
| SCHEMBL11580966 | 1.00 | NR3C1 (0.86) | NR3C1CYP3A4PGRUSP2LMNA | |
| SCHEMBL11582511 | 1.00 | NR3C1 (0.86) | NR3C1CYP3A4PGRUSP2LMNA | |
| SCHEMBL11749842 | 1.00 | NR3C1 (0.86) | NR3C1CYP3A4PGRUSP2LMNA | |
| SCHEMBL11582462 | 1.00 | NR3C1 (0.86) | NR3C1CYP3A4PGRUSP2LMNA | |
| Amelometasone SCHEMBL140206 | 0.94 | NR3C1 (0.88) | NR3C1CYP3A4PGRUSP2LMNA | |
| SCHEMBL11581003 | 0.94 | NR3C1 (0.81) | NR3C1CYP3A4PGRUSP2LMNA | |
| SCHEMBL11581627 | 0.94 | NR3C1 (0.81) | NR3C1CYP3A4PGRUSP2LMNA | |
| SCHEMBL11581006 | 0.94 | NR3C1 (0.81) | NR3C1CYP3A4PGRUSP2LMNA | |
| SCHEMBL25372269 | 0.93 | NR3C1 (0.87) | NR3C1CYP3A4PGRUSP2LMNA | |
| SCHEMBL9768478 | 0.93 | NR3C1 (0.87) | NR3C1CYP3A4PGRUSP2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-4113680-A | Method for preparing 17 α-ester-21-halo pregnanes | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 1978-09-12 | — | — | US | disclosed |
| US-4021459-A | Process for the preparation of 21-halogeno-21-desoxy-17α-acyloxy 20-keto-pregnenes | SCHERING CORPORATION (US) | 1977-05-03 | — | — | US | disclosed |
| US-3992422-A | Process for the preparation of 21-halogeno-21-desoxy-17α-acyloxy-20-keto-pregnenes | SCHERING CORPORATION (US) | 1976-11-16 | — | — | US | disclosed |