⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL9719386 | 0.98 | — | — | |
| SCHEMBL3300137 | 0.77 | — | — | |
| SCHEMBL11678773 | 0.77 | SPHK1 (0.35) | — | |
| SCHEMBL3308770 | 0.75 | — | — | |
| SCHEMBL4441743 | 0.75 | SPHK1 (0.32) | — | |
| SCHEMBL7534497 | 0.75 | SPHK1 (0.32) | — | |
| SCHEMBL7562574 | 0.75 | SPHK1 (0.32) | — | |
| SCHEMBL7540577 | 0.75 | SPHK1 (0.32) | — | |
| SCHEMBL6262047 | 0.74 | SIRT2 (0.32) | — | |
| SCHEMBL29069414 | 0.74 | SIRT2 (0.33) | — |
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-107849248-A | The laser induced increasing material manufacturing of polyimide precursor | 沙特基础工业全球技术有限公司 | 2018-03-27 | — | — | CN | disclosed |