⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL304142 | 0.83 | — | — | |
| SCHEMBL8570255 | 0.82 | — | — | |
| SCHEMBL28964850 | 0.79 | — | — | |
| SCHEMBL56081 | 0.72 | — | — | |
| SCHEMBL7093179 | 0.70 | — | — | |
| SCHEMBL108964 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL6409745 | 0.70 | — | — | |
| SCHEMBL15049950 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL28426598 | 0.70 | — | — | |
| SCHEMBL29015750 | 0.70 | KCNN4 (0.34) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-8199132-A | — | — | None | — | — | JP | disclosed |
| JP-H08199132-A | ADHESIVE COMPOSITION | NIPPON SYNTHETIC CHEM IND CO LTD:THE | 1996-08-06 | — | — | JP | disclosed |