⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21859330 | 0.60 | — | — | |
| SCHEMBL22622737 | 0.55 | — | — | |
| SCHEMBL12197754 | 0.54 | RAPGEF4 (0.32) | — | |
| SCHEMBL15723815 | 0.54 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL22667991 | 0.53 | — | — | |
| SCHEMBL21859418 | 0.53 | CA2 (0.33) | — | |
| SCHEMBL8737200 | 0.52 | ALDH1A1 (0.32) | — | |
| SCHEMBL21301364 | 0.51 | — | — | |
| SCHEMBL12018419 | 0.50 | — | — | |
| SCHEMBL21106026 | 0.48 | LPO (0.38) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |