⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28584537 | 0.78 | — | — | |
| SCHEMBL28176673 | 0.78 | — | — | |
| SCHEMBL9582375 | 0.76 | KDM4E (0.36) | — | |
| SCHEMBL14080380 | 0.72 | — | — | |
| SCHEMBL9587297 | 0.68 | MEN1 (0.43) | — | |
| SCHEMBL14080610 | 0.68 | — | — | |
| SCHEMBL9587024 | 0.67 | NPC1 (0.32) | — | |
| SCHEMBL28140537 | 0.67 | KDM4E (0.33) | — | |
| SCHEMBL11331195 | 0.67 | KDM4E (0.33) | — | |
| SCHEMBL28757531 | 0.67 | KDM4E (0.37) | — |
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-114015064-A | Porphyrin MOF nanosheet with ultrasonic stimulus response, and preparation method and application thereof | 河南大学 | 2022-02-08 | — | — | CN | disclosed |