⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27955116 | 0.97 | ACE (0.38) | — | |
| SCHEMBL2983461 | 0.84 | POLB (0.35) | — | |
| SCHEMBL3517261 | 0.84 | POLB (0.35) | — | |
| SCHEMBL3515949 | 0.84 | POLB (0.35) | — | |
| SCHEMBL3340426 | 0.82 | POLB (0.41) | — | |
| SCHEMBL4936887 | 0.82 | POLB (0.41) | — | |
| SCHEMBL474931 | 0.82 | POLB (0.41) | — | |
| SCHEMBL10760759 | 0.82 | PARP1 (0.41) | — | |
| SCHEMBL10760768 | 0.82 | PARP1 (0.41) | — | |
| SCHEMBL19658200 | 0.77 | ACE (0.41) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2511605-B2 | — | — | 1996-07-03 | — | — | JP | claimed |
| EP-0536163-A1 | AROMATIC PYRROLIDINE AND THIAZOLIDINE AMIDES | PFIZER INC. (US) | 1993-04-14 | — | — | EP | claimed |
| WO-1991018891-A1 | AROMATIC PYRROLIDINE AND THIAZOLIDINE AMIDES | PFIZER INC. (US) | 1991-12-12 | — | — | WO | claimed |
| US-5847155-A | Aromatic pyrrolidine amide prolyl endopeptidase inhibitors | PFIZER INC (US) | 1998-12-08 | — | — | US | disclosed |
| EP-0536163-A1 | AROMATIC PYRROLIDINE AND THIAZOLIDINE AMIDES | PFIZER INC. (US) | 1993-04-14 | — | — | EP | disclosed |
| WO-1991018891-A1 | AROMATIC PYRROLIDINE AND THIAZOLIDINE AMIDES | PFIZER INC. (US) | 1991-12-12 | — | — | WO | disclosed |