⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23488248 | 0.84 | KDM4E (0.31) | — | |
| SCHEMBL21783613 | 0.78 | NR1H2 (0.35) | — | |
| SCHEMBL21783605 | 0.78 | NR1H2 (0.35) | — | |
| SCHEMBL23488165 | 0.78 | NR1H2 (0.35) | — | |
| SCHEMBL2028396 | 0.73 | ADH5 (0.32) | — | |
| SCHEMBL184092 | 0.71 | DCUN1D1 (0.44) | — | |
| SCHEMBL16473172 | 0.71 | LMNA (0.38) | — | |
| SCHEMBL7432657 | 0.71 | XDH (0.51) | — | |
| SCHEMBL751010 | 0.71 | MKNK1 (0.42) | — | |
| SCHEMBL13411813 | 0.71 | ADH5 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020043087-A1 | METHOD OF DETECTING HUMAN SERUM ALBUMIN IN BIOLOGICAL FLUIDS | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2020-03-05 | — | — | WO | disclosed |