⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20820982 | 0.81 | — | — | |
| SCHEMBL21281784 | 0.75 | — | — | |
| SCHEMBL22432364 | 0.70 | — | — | |
| SCHEMBL18786075 | 0.69 | — | — | |
| SCHEMBL13219528 | 0.67 | CYP19A1 (0.35) | — | |
| SCHEMBL3414743 | 0.64 | — | — | |
| SCHEMBL18897983 | 0.64 | — | — | |
| SCHEMBL17548677 | 0.64 | MEN1 (0.35) | — | |
| SCHEMBL20306487 | 0.63 | — | — | |
| SCHEMBL12716328 | 0.62 | SMN1; SMN2 (0.51) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180024435-A1 | RESIST COMPOSITION AND PATTERNING PROCESS USING THE SAME | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2018-01-25 | — | — | US | disclosed |