⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9850668 | 0.81 | — | — | |
| SCHEMBL9513593 | 0.79 | — | — | |
| SCHEMBL27671098 | 0.79 | — | — | |
| SCHEMBL27731134 | 0.74 | — | — | |
| SCHEMBL27625218 | 0.74 | — | — | |
| SCHEMBL1637783 | 0.73 | — | — | |
| SCHEMBL20007397 | 0.72 | — | — | |
| SCHEMBL28719613 | 0.71 | — | — | |
| SCHEMBL5326186 | 0.71 | — | — | |
| SCHEMBL28041951 | 0.70 | — | — |
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-107921292-B | Method for strengthening hair fibers and protecting dyed hair from fading and washing off | 赫尔克里士有限公司 | 2021-06-22 | — | — | CN | disclosed |