⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21859417 | 0.86 | INMT (0.56) | — | |
| SCHEMBL1698643 | 0.75 | — | — | |
| SCHEMBL9681470 | 0.70 | — | — | |
| SCHEMBL1985860 | 0.67 | HPGD (0.32) | — | |
| SCHEMBL13472021 | 0.67 | INMT (0.30) | — | |
| SCHEMBL11627926 | 0.63 | — | — | |
| SCHEMBL12156835 | 0.63 | INMT (0.31) | — | |
| SCHEMBL11623959 | 0.63 | — | — | |
| SCHEMBL19758174 | 0.63 | — | — | |
| SCHEMBL1698475 | 0.62 | INMT (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230012362-A1 | WDR5 INHIBITORS AND MODULATORS | VANDERBILT UNIVERSITY | 2023-01-12 | — | — | US | disclosed |
| US-10844044-B2 | WDR5 inhibitors and modulators | VANDERBILT UNIVERSITY (US) | 2020-11-24 | — | — | US | disclosed |
| US-20200102288-A1 | WDR5 INHIBITORS AND MODULATORS | VANDERBILT UNIVERSITY | 2020-04-02 | — | — | US | disclosed |