⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29540564 | 0.77 | FGFR1 (0.33) | — | |
| SCHEMBL5062914 | 0.73 | KDM4E (0.32) | — | |
| Hydrochloric Acid SCHEMBL21174542 | 0.72 | KDM4E (0.32) | — | |
| SCHEMBL8710364 | 0.70 | HPRT1 (0.33) | — | |
| SCHEMBL11066168 | 0.70 | PDK2 (0.35) | — | |
| SCHEMBL9936008 | 0.70 | KDM4E (0.32) | — | |
| SCHEMBL6999928 | 0.70 | — | — | |
| SCHEMBL30865757 | 0.69 | AXL (0.32) | — | |
| SCHEMBL7201342 | 0.69 | NPC1 (0.30) | — | |
| SCHEMBL6948806 | 0.67 | JAK2 (0.32) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112638380-B | Cerebellar protein (CRBN) ligands | 达纳-法伯癌症研究所有限公司 | 2024-05-24 | — | — | CN | disclosed |