⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4784984 | 0.78 | POLB (0.31) | — | |
| Hydrochloric Acid SCHEMBL4784851 | 0.76 | POLB (0.30) | — | |
| SCHEMBL22792063 | 0.74 | NPC1 (0.36) | — | |
| SCHEMBL5092152 | 0.67 | HSD11B1 (0.60) | — | |
| SCHEMBL391111 | 0.67 | — | — | |
| SCHEMBL11844576 | 0.67 | HSD11B1 (0.38) | — | |
| SCHEMBL10011830 | 0.66 | — | — | |
| SCHEMBL19281543 | 0.64 | HSD11B1 (0.33) | — | |
| SCHEMBL14505510 | 0.63 | BRD9 (0.37) | — | |
| SCHEMBL21152461 | 0.63 | DPP4 (0.33) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10730865-B2 | Compounds for modulating aquaporins | APOGLYX AB (SE) | 2020-08-04 | — | — | US | disclosed |
| US-10730865-B2 | Compounds for modulating aquaporins | APOGLYX AB (SE) | 2020-08-04 | — | — | US | disclosed |
| US-20190127360-A1 | COMPOUNDS FOR MODULATING AQUAPORINS | APOGLYX AB (SE) | 2019-05-02 | — | — | US | disclosed |
| US-20190127360-A1 | COMPOUNDS FOR MODULATING AQUAPORINS | APOGLYX AB (SE) | 2019-05-02 | — | — | US | disclosed |
| WO-2017186893-A1 | COMPOUNDS FOR MODULATING AQUAPORINS | APOGLYX AB (SE) | 2017-11-02 | — | — | WO | disclosed |
| WO-2017186893-A1 | COMPOUNDS FOR MODULATING AQUAPORINS | APOGLYX AB (SE) | 2017-11-02 | — | — | WO | disclosed |
| WO-2008074991-A1 | NOVEL HERBICIDES | SYNGENTA LIMITED (GB) | 2008-06-26 | — | — | WO | disclosed |