⚠ 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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL1736019 | 0.90 | TP53 (0.30) | — | |
| Pyridine SCHEMBL16702934 | 0.90 | TP53 (0.30) | — | |
| Pyridine SCHEMBL11087275 | 0.90 | TP53 (0.30) | — | |
| Pyridine SCHEMBL31579081 | 0.90 | — | — | |
| Pyridine SCHEMBL31757303 | 0.90 | TP53 (0.30) | — | |
| Pyridine SCHEMBL29384311 | 0.90 | — | — | |
| Pyridine SCHEMBL30320033 | 0.90 | TP53 (0.30) | — | |
| Pyridine SCHEMBL28501576 | 0.86 | — | — | |
| Pyridine SCHEMBL9622112 | 0.86 | — | — | |
| Pyridine SCHEMBL30336469 | 0.86 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116948070-B | Polybutene-1 and preparation method thereof, non-metallocene catalyst used in polybutene-1 and preparation method thereof | 中国石油天然气股份有限公司 | 2026-05-15 | — | — | CN | disclosed |
| CN-116948070-A | Polybutene-1 and preparation method thereof, non-metallocene catalyst used in polybutene-1 and preparation method thereof | 中国石油天然气股份有限公司 | 2023-10-27 | — | — | CN | disclosed |