⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4014285 | 1.00 | — | — | |
| SCHEMBL4014282 | 1.00 | — | — | |
| SCHEMBL4009438 | 0.79 | ALDH1A1 (0.30) | — | |
| SCHEMBL4009435 | 0.79 | ALDH1A1 (0.30) | — | |
| SCHEMBL4009442 | 0.79 | ALDH1A1 (0.30) | — | |
| SCHEMBL14105524 | 0.76 | — | — | |
| SCHEMBL14105563 | 0.76 | — | — | |
| Isobutyraldehyde SCHEMBL8346903 | 0.74 | — | — | |
| SCHEMBL9180674 | 0.74 | TSHR (0.30) | — | |
| SCHEMBL4007843 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1926709-A4 | PROCESS FOR THE PREPARATION OF CHIRAL 3-HYDROXY PYRROLIDINE COMPOUND AND DERIVATIVES THEREOF HAVING HIGH OPTICAL PURITY | RSTECH CORP (KR) | 2009-06-24 | — | — | EP | disclosed |
| EP-1926709-A1 | PROCESS FOR THE PREPARATION OF CHIRAL 3-HYDROXY PYRROLIDINE COMPOUND AND DERIVATIVES THEREOF HAVING HIGH OPTICAL PURITY | RStech Corporation (KR) | 2008-06-04 | — | — | EP | disclosed |
| WO-2007024113-A1 | PROCESS FOR THE PREPARATION OF CHIRAL 3-HYDROXY PYRROLIDINE COMPOUND AND DERIVATIVES THEREOF HAVING HIGH OPTICAL PURITY | RSTECH CORPORATION (KR) | 2007-03-01 | — | — | WO | disclosed |