⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1773036 | 1.00 | — | — | |
| Phosphine SCHEMBL27659518 | 0.94 | — | — | |
| SCHEMBL27961446 | 0.93 | — | — | |
| SCHEMBL28610712 | 0.93 | — | — | |
| SCHEMBL28215678 | 0.93 | — | — | |
| SCHEMBL11675084 | 0.93 | — | — | |
| SCHEMBL28076857 | 0.93 | — | — | |
| SCHEMBL7570151 | 0.86 | — | — | |
| SCHEMBL28772066 | 0.86 | — | — | |
| Water SCHEMBL6549361 | 0.86 | — | — |
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-108137902-B | Heat-activatable fast-curing adhesive coating | 卡塞尔大学 | 2021-05-25 | — | — | CN | disclosed |