⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28860083 | 0.72 | — | — | |
| SCHEMBL17075264 | 0.69 | ALDH1A1 (0.30) | — | |
| SCHEMBL8587755 | 0.69 | — | — | |
| SCHEMBL11144352 | 0.67 | HCAR2 (0.43) | — | |
| SCHEMBL16431049 | 0.67 | MGAM (0.33) | — | |
| SCHEMBL11219545 | 0.67 | — | — | |
| SCHEMBL28961272 | 0.67 | — | — | |
| SCHEMBL9067452 | 0.67 | — | — | |
| SCHEMBL11435255 | 0.67 | — | — | |
| SCHEMBL11211880 | 0.65 | — | — |
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-115306350-A | Controllable soluble ball used for matching with oil well sliding sleeve | 江苏康帕斯油气工程有限公司 | 2022-11-08 | — | — | CN | disclosed |