⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27541 | 0.78 | — | — | |
| SCHEMBL12526375 | 0.78 | — | — | |
| SCHEMBL260464 | 0.78 | — | — | |
| SCHEMBL4773512 | 0.78 | CCR5 (0.67) | — | |
| SCHEMBL1162548 | 0.78 | — | — | |
| SCHEMBL1338772 | 0.78 | — | — | |
| SCHEMBL1338774 | 0.78 | — | — | |
| SCHEMBL18026798 | 0.77 | CHRNB2 (0.30) | — | |
| Hydrochloric Acid SCHEMBL1613839 | 0.74 | — | — | |
| SCHEMBL9657294 | 0.74 | CCR5 (0.61) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023064345-A1 | SMALL MOLECULE MODULATORS OF GLUCOCEREBROSIDASE ACTIVITY AND USES THEREOF | VANQUA BIO, INC. (US) | 2023-04-20 | — | — | WO | disclosed |
| EP-3329918-A2 | C-MET MODULATORS AND METHODS OF USE | Exelixis, Inc. (US) | 2018-06-06 | — | — | EP | disclosed |