⚠ 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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL28422975 | 0.91 | HTT (0.39) | — | |
| SCHEMBL27417808 | 0.79 | HTT (0.44) | — | |
| SCHEMBL7899169 | 0.79 | HTT (0.44) | — | |
| SCHEMBL7787905 | 0.77 | — | — | |
| SCHEMBL175495 | 0.76 | HTT (0.45) | — | |
| SCHEMBL10608081 | 0.76 | — | — | |
| SCHEMBL1640508 | 0.76 | HTT (0.45) | — | |
| SCHEMBL8668364 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL8646283 | 0.74 | HTT (0.44) | — | |
| SCHEMBL4557486 | 0.74 | — | — |
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-111356762-A | Lipase variants and microcapsule compositions comprising such lipase variants | 诺维信公司 | 2020-06-30 | — | — | CN | disclosed |