⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10306782 | 0.83 | TSHR (0.38) | — | |
| SCHEMBL6665942 | 0.77 | FDPS (0.33) | — | |
| SCHEMBL9085261 | 0.77 | TSHR (0.33) | — | |
| SCHEMBL9062486 | 0.75 | TSHR (0.32) | — | |
| SCHEMBL8527753 | 0.75 | TSHR (0.32) | — | |
| SCHEMBL543718 | 0.73 | — | — | |
| Ammonia Solution, Strong SCHEMBL14840311 | 0.73 | TSHR (0.30) | — | |
| SCHEMBL17472508 | 0.73 | — | — | |
| SCHEMBL9079306 | 0.73 | — | — | |
| Phosphine SCHEMBL28804791 | 0.73 | TSHR (0.30) | — |
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-2021112172-A1 | CLEANING AGENT, AND CLEANING METHOD AND CLEANING DEVICE USING CLEANING AGENT | セントラル硝子株式会社 | 2021-06-10 | — | — | WO | disclosed |