⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19970656 | 0.91 | PIM1 (0.30) | — | |
| SCHEMBL19970474 | 0.90 | CSNK2A2 (0.33) | — | |
| SCHEMBL132262 | 0.88 | GNAI3 (0.30) | — | |
| SCHEMBL129602 | 0.86 | GNAI3 (0.33) | — | |
| SCHEMBL4063620 | 0.81 | — | — | |
| Piperazine SCHEMBL28868943 | 0.81 | CXCR4 (0.33) | — | |
| SCHEMBL130373 | 0.79 | — | — | |
| SCHEMBL4064033 | 0.79 | CSNK2A2 (0.32) | — | |
| SCHEMBL8758990 | 0.78 | GNAI3 (0.35) | — | |
| SCHEMBL10601364 | 0.78 | GNAI3 (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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107849160-B | Modified conjugated diene polymer, preparation method thereof and modifier | 株式会社LG化学 | 2020-05-12 | — | — | CN | disclosed |
| EP-3296322-B1 | MODIFIED CONJUGATED DIENE POLYMER, PRODUCTION METHOD THEREFOR, AND MODIFIER | LG CHEMICAL LTD (KR) | 2019-04-10 | — | — | EP | disclosed |
| US-20180305470-A1 | MODIFIED AND CONJUGATED DIENE-BASED POLYMER, METHOD FOR PREPARING THE SAME, AND MODIFIER | LG CHEM, LTD. (KR) | 2018-10-25 | — | — | US | disclosed |
| EP-3296322-A1 | MODIFIED CONJUGATED DIENE POLYMER, PRODUCTION METHOD THEREFOR, AND MODIFIER | LG Chem, Ltd. (KR) | 2018-03-21 | — | — | EP | disclosed |