⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1966761 | 0.80 | — | — | |
| SCHEMBL23795144 | 0.77 | — | — | |
| SCHEMBL2429525 | 0.76 | GRIN2B (0.41) | — | |
| SCHEMBL3370511 | 0.76 | GRIN2B (0.41) | — | |
| SCHEMBL3510999 | 0.76 | — | — | |
| SCHEMBL3510998 | 0.76 | — | — | |
| SCHEMBL5072354 | 0.76 | SLC6A1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL7326363 | 0.75 | DPP4 (0.36) | — | |
| SCHEMBL4800652 | 0.75 | FFAR3 (0.31) | — | |
| SCHEMBL1966290 | 0.74 | CYP2C19 (0.30) | — |
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-2004601-A1 | NOVEL DIPEPTIDYL PEPTIDASE IV INHIBITORS AND PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Matrix Laboratories Limited (IN) | 2008-12-24 | — | — | EP | disclosed |
| WO-2007113634-A1 | NOVEL DIPEPTIDYL PEPTIDASE IV INHIBITORS AND PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MATRIX LABORATORIES LTD. (DE) | 2007-10-11 | — | — | WO | disclosed |
| WO-2004099185-A1 | 2-CYANOPYRROLIDINE DERIVATIVES AND THEIR USE AS DPP-IV INHIBITORS | FUJISAWA PHARMACEUTICAL CO. LTD. (JP) | 2004-11-18 | — | — | WO | disclosed |