⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19970654 | 0.91 | CA12 (0.31) | — | |
| SCHEMBL3038689 | 0.79 | CA12 (0.31) | — | |
| SCHEMBL961553 | 0.76 | ALOX15 (0.30) | — | |
| SCHEMBL19983357 | 0.75 | CA12 (0.31) | — | |
| SCHEMBL9764063 | 0.75 | — | — | |
| SCHEMBL5916624 | 0.74 | LMNA (0.35) | — | |
| SCHEMBL9764016 | 0.72 | ZDHHC20 (0.41) | — | |
| SCHEMBL2558404 | 0.72 | CA12 (0.31) | — | |
| SCHEMBL17133234 | 0.71 | — | — | |
| SCHEMBL5916811 | 0.70 | LMNA (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3296323-B1 | MODIFIED CONJUGATED DIENE-BASED POLYMER AND PREPARATION METHOD THEREFOR | LG CHEMICAL LTD (KR) | 2020-09-30 | — | — | EP | disclosed |
| EP-3296323-A1 | MODIFIED CONJUGATED DIENE-BASED POLYMER AND PREPARATION METHOD THEREFOR | LG Chem, Ltd. (KR) | 2018-03-21 | — | — | EP | disclosed |