⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9738566 | 0.98 | FNTA (0.30) | — | |
| SCHEMBL9450271 | 0.79 | — | — | |
| SCHEMBL9450278 | 0.76 | — | — | |
| SCHEMBL9450263 | 0.76 | — | — | |
| SCHEMBL9363135 | 0.71 | — | — | |
| SCHEMBL10001960 | 0.67 | — | — | |
| SCHEMBL7188653 | 0.65 | CYP19A1 (0.32) | — | |
| SCHEMBL7188664 | 0.65 | CYP19A1 (0.32) | — | |
| SCHEMBL7188658 | 0.65 | CYP19A1 (0.32) | — | |
| SCHEMBL17554567 | 0.64 | FNTA (0.36) | — |
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-117343034-A | Toughening nucleating agent for polypropylene and preparation method thereof | 北方华锦化学工业股份有限公司 | 2024-01-05 | — | — | CN | disclosed |