⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28279674 | 0.79 | — | — | |
| SCHEMBL28869925 | 0.76 | — | — | |
| SCHEMBL28280797 | 0.74 | ALDH1A1 (0.36) | — | |
| SCHEMBL27723931 | 0.72 | FDPS (0.38) | — | |
| SCHEMBL11407378 | 0.72 | PPARD (0.30) | — | |
| SCHEMBL27610839 | 0.71 | FDPS (0.32) | — | |
| SCHEMBL28279675 | 0.70 | DNM1 (0.40) | — | |
| SCHEMBL28022684 | 0.69 | BTN3A1 (0.31) | — | |
| SCHEMBL10883235 | 0.69 | MAPT (0.33) | — | |
| SCHEMBL28434395 | 0.69 | KEAP1 (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-117820631-A | Branching viscosity reduction monomer, branching structure viscosity reduction type polycarboxylate superplasticizer and preparation method thereof | 科之杰新材料集团有限公司 | 2024-04-05 | — | — | CN | disclosed |