⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4891822 | 0.81 | NPSR1 (0.41) | — | |
| SCHEMBL3725173 | 0.76 | — | — | |
| SCHEMBL19308 | 0.73 | — | — | |
| SCHEMBL2183127 | 0.73 | — | — | |
| SCHEMBL313044 | 0.73 | — | — | |
| SCHEMBL3721440 | 0.72 | — | — | |
| SCHEMBL28719318 | 0.72 | — | — | |
| SCHEMBL9215170 | 0.72 | — | — | |
| SCHEMBL28805320 | 0.72 | — | — | |
| SCHEMBL11769518 | 0.71 | — | — |
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-1102860-A1 | 4-HYDROXYPROLINE EPIMERASE FROM ACINETOBACTER BAUMANNI AND SERRATIA MARCESCENS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2001-05-30 | — | — | EP | disclosed |
| WO-2000008200-A1 | 4-HYDROXYPROLINE EPIMERASE FROM $I(ACINETOBACTER BAUMANNI) AND $I(SERRATIA MARCESCENS) | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-02-17 | — | — | WO | disclosed |