⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL27509989 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL2478484 | 0.74 | AKR1C4 (0.33) | — | |
| SCHEMBL2477637 | 0.74 | AKR1C4 (0.33) | — | |
| SCHEMBL7340951 | 0.63 | MEN1 (0.31) | — | |
| SCHEMBL2043119 | 0.60 | CYP1A2 (0.42) | — | |
| SCHEMBL11795172 | 0.60 | CYP2C19 (0.34) | — | |
| SCHEMBL10385807 | 0.60 | CYP19A1 (0.33) | — | |
| SCHEMBL1931831 | 0.59 | AKR1C4 (0.45) | — | |
| SCHEMBL896555 | 0.59 | AKR1C4 (0.45) | — | |
| SCHEMBL10895903 | 0.59 | CYP2C19 (0.34) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1948584-B1 | PROCESS FOR THE PREPARATION OF CYCLOPENTANONE DERIVATIVES | FIRMENICH & CIE (CH) | 2011-10-19 | — | — | EP | disclosed |
| EP-1948584-B1 | PROCESS FOR THE PREPARATION OF CYCLOPENTANONE DERIVATIVES | FIRMENICH & CIE (CH) | 2011-10-19 | — | — | EP | disclosed |
| US-7649107-B2 | Process for the preparation of cyclopentanone derivatives | FIRMENICH SA (CH) | 2010-01-19 | — | — | US | disclosed |
| US-7649107-B2 | Process for the preparation of cyclopentanone derivatives | FIRMENICH SA (CH) | 2010-01-19 | — | — | US | disclosed |
| US-20080214859-A1 | Process for the Preparation of Cyclopentanone Derivatives | FIRMENICH SA (CH) | 2008-09-04 | — | — | US | disclosed |
| US-20080214859-A1 | Process for the Preparation of Cyclopentanone Derivatives | FIRMENICH SA (CH) | 2008-09-04 | — | — | US | disclosed |
| EP-1948584-A2 | PROCESS FOR THE PREPARATION OF CYCLOPENTANONE DERIVATIVES | Firmenich SA (CH) | 2008-07-30 | — | — | EP | disclosed |
| WO-2007056129-A3 | PROCESS FOR THE PREPARATION OF CYCLOPENTANONE DERIVATIVES | FIRMENICH & CIE (CH) | 2007-07-05 | — | — | WO | disclosed |
| WO-2007056129-A2 | PROCESS FOR THE PREPARATION OF CYCLOPENTANONE DERIVATIVES | FIRMENICH SA (CH) | 2007-05-18 | — | — | WO | disclosed |