⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL466965 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL8209580 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL5165812 | 0.70 | — | — | |
| SCHEMBL180000 | 0.70 | — | — | |
| SCHEMBL6803316 | 0.65 | — | — | |
| SCHEMBL1484247 | 0.64 | — | — | |
| SCHEMBL28809817 | 0.64 | HRH3 (0.35) | — | |
| SCHEMBL4393759 | 0.63 | — | — | |
| SCHEMBL7411501 | 0.62 | ALDH1A1 (0.35) | — | |
| SCHEMBL8172667 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-107805254-B | Porphyrin micromolecular perovskite cathode buffer layer material and preparation method and application thereof | 华南理工大学 | 2020-08-18 | — | — | CN | claimed |
| CN-107805254-B | Porphyrin micromolecular perovskite cathode buffer layer material and preparation method and application thereof | 华南理工大学 | 2020-08-18 | — | — | CN | disclosed |