⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15512217 | 0.84 | ALDH1A1 (0.31) | — | |
| SCHEMBL16320228 | 0.84 | ALDH1A1 (0.31) | — | |
| SCHEMBL11809967 | 0.83 | TSHR (0.32) | — | |
| SCHEMBL3608859 | 0.82 | — | — | |
| SCHEMBL22587 | 0.78 | ALDH1A1 (0.36) | — | |
| SCHEMBL28649 | 0.78 | ALDH1A1 (0.36) | — | |
| SCHEMBL15864178 | 0.77 | — | — | |
| SCHEMBL2590300 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL8911469 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL9242821 | 0.75 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2993194-B1 | MULTI-BLOCK COPOLYMER | LG CHEMICAL LTD (KR) | 2019-07-03 | — | — | EP | disclosed |
| US-9315697-B2 | Multi-block copolymer | LG CHEM, LTD. (KR) | 2016-04-19 | — | — | US | disclosed |
| EP-2993194-A1 | MULTI-BLOCK COPOLYMER | LG Chem, Ltd. (KR) | 2016-03-09 | — | — | EP | disclosed |