⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28363483 | 0.76 | — | — | |
| SCHEMBL28354962 | 0.75 | — | — | |
| SCHEMBL28557687 | 0.75 | RAB9A (0.33) | — | |
| SCHEMBL4359476 | 0.74 | CCR1 (0.43) | — | |
| SCHEMBL28985236 | 0.73 | — | — | |
| SCHEMBL29209970 | 0.72 | — | — | |
| SCHEMBL28999748 | 0.71 | — | — | |
| SCHEMBL28670275 | 0.70 | CRHBP (0.32) | — | |
| SCHEMBL28755102 | 0.70 | — | — | |
| SCHEMBL1275382 | 0.69 | MAOA (0.31) | — |
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-117683038-A | Preparation method of tetraphenylporphyrin compound | 中国石化扬子石油化工有限公司 | 2024-03-12 | — | — | CN | disclosed |