⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8184317 | 0.97 | DPP7 (0.52) | — | |
| SCHEMBL25697034 | 0.95 | — | — | |
| SCHEMBL3369666 | 0.89 | — | — | |
| SCHEMBL19753009 | 0.81 | EPHX1 (0.40) | — | |
| SCHEMBL7473497 | 0.78 | DPP7 (0.31) | — | |
| SCHEMBL26613901 | 0.77 | DPP7 (0.42) | — | |
| SCHEMBL2297128 | 0.75 | EPHX2 (0.34) | — | |
| SCHEMBL818299 | 0.74 | — | — | |
| SCHEMBL14007442 | 0.73 | ADH1B (0.44) | — | |
| SCHEMBL25167602 | 0.72 | DPP7 (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3159345-A1 | INHIBITORS OF HEPATITIS C VIRUS | Gilead Sciences, Inc. (US) | 2017-04-26 | — | — | EP | disclosed |
| US-5723442-A | OLIGOPEPTIDES AS HUMAN LEUKOCYTE ELASTASE INHIBITORS | ZENECA INC. (US) | 1998-03-03 | — | — | US | disclosed |
| EP-0399688-B1 | Trifluoroketopeptide derivatives useful as human leukocyte elastase inhibitors | ZENECA INC (US) | 1994-06-22 | — | — | EP | disclosed |
| EP-0397427-B1 | Fluoro-amide derivatives having human leucocyte elastase inhibiting activity | ZENECA INC (US) | 1994-05-04 | — | — | EP | disclosed |
| US-5270301-A | Fluoro-amide derivatives | ICI AMERICAS INC. (US) | 1993-12-14 | — | — | US | disclosed |
| EP-0397427-A1 | Fluoro-amide derivatives having human leucocyte elastase inhibiting activity | ZENECA INC. (US) | 1990-11-14 | — | — | EP | disclosed |