⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21329 | 0.80 | — | — | |
| SCHEMBL367920 | 0.80 | TSHR (0.62) | — | |
| SCHEMBL2295699 | 0.80 | TSHR (0.62) | — | |
| SCHEMBL26254 | 0.80 | — | — | |
| Carbamic Acid SCHEMBL286743 | 0.76 | — | — | |
| Carbamic Acid SCHEMBL28066638 | 0.76 | ACHE (0.70) | — | |
| Bicarbonate SCHEMBL8726606 | 0.76 | — | — | |
| Urea SCHEMBL5996634 | 0.76 | — | — | |
| Methane SCHEMBL11423626 | 0.75 | TSHR (0.56) | — | |
| SCHEMBL14674600 | 0.75 | — | — |
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-109803664-A | Agents, compositions and methods for improving viability and function of cells, tissues and organs | 尚特·德扎尔基西安 | 2019-05-24 | — | — | CN | disclosed |