⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6902794 | 0.88 | ALDH1A1 (0.31) | — | |
| SCHEMBL6905975 | 0.86 | — | — | |
| SCHEMBL6907675 | 0.86 | CTSV (0.30) | — | |
| SCHEMBL6908534 | 0.79 | EPHX2 (0.31) | — | |
| SCHEMBL19130345 | 0.75 | — | — | |
| SCHEMBL6905482 | 0.75 | EPHX2 (0.32) | — | |
| SCHEMBL19130350 | 0.75 | — | — | |
| SCHEMBL6905987 | 0.73 | — | — | |
| SCHEMBL1130205 | 0.73 | EPHX2 (0.33) | — | |
| SCHEMBL1130683 | 0.73 | EPHX2 (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 |
|---|---|---|---|---|---|---|---|
| US-6689849-B1 | Catalyst for bulk polymerization, catalyst for vapor phase polymerization, method of polymerization using these, and olefin polymer obtained with these | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2004-02-10 | — | — | US | disclosed |