Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C4 | P17516 | 1/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | ACE | P12821 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL2480706 | 0.87 | THRB (0.40) | KMT2A | |
| SCHEMBL2479884 | 0.87 | THRB (0.40) | KMT2A | |
| SCHEMBL2478853 | 0.87 | ACE (0.38) | AKR1C4AKR1C3AKR1C2ACE | |
| SCHEMBL2476814 | 0.87 | ACE (0.38) | AKR1C4AKR1C3AKR1C2ACE | |
| SCHEMBL3678426 | 0.76 | AKR1C4 (0.54) | AKR1C4AKR1C3AKR1C2HTT | |
| SCHEMBL3676451 | 0.76 | AKR1C4 (0.54) | AKR1C4AKR1C3AKR1C2HTT | |
| SCHEMBL5872360 | 0.73 | PTGER2 (0.45) | HTTKMT2A | |
| SCHEMBL5080170 | 0.73 | CHRM2 (0.35) | KMT2A | |
| SCHEMBL11417780 | 0.70 | PTGER2 (0.43) | HTTKMT2A | |
| SCHEMBL18088606 | 0.67 | THRB (0.41) | AKR1C4AKR1C3AKR1C2HTTKMT2A |
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-7649107-B2 | Process for the preparation of cyclopentanone derivatives | FIRMENICH SA (CH) | 2010-01-19 | — | — | US | disclosed |
| EP-1948584-A2 | PROCESS FOR THE PREPARATION OF CYCLOPENTANONE DERIVATIVES | Firmenich SA (CH) | 2008-07-30 | — | — | EP | disclosed |
| WO-2007056129-A2 | PROCESS FOR THE PREPARATION OF CYCLOPENTANONE DERIVATIVES | FIRMENICH SA (CH) | 2007-05-18 | — | — | WO | disclosed |