⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19894436 | 0.53 | — | — | |
| SCHEMBL14898601 | 0.43 | — | — | |
| SCHEMBL19505760 | 0.43 | — | — | |
| SCHEMBL21682982 | 0.43 | — | — | |
| SCHEMBL20043110 | 0.43 | — | — | |
| SCHEMBL25457582 | 0.43 | — | — | |
| Ammonia Solution, Strong SCHEMBL8425786 | 0.40 | — | — | |
| SCHEMBL5383540 | 0.35 | — | — | |
| SCHEMBL1468768 | 0.35 | — | — | |
| Hydrogen Sulfide SCHEMBL1412215 | 0.35 | — | — |
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-10604654-B2 | Curable resin composition | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2020-03-31 | — | — | US | disclosed |