⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL181395 | 0.92 | ATM (0.33) | — | |
| SCHEMBL181363 | 0.88 | CHRNB2 (0.30) | — | |
| SCHEMBL181569 | 0.76 | CHRNB2 (0.33) | — | |
| SCHEMBL18487402 | 0.76 | HCAR2 (0.39) | — | |
| SCHEMBL6279641 | 0.67 | MAPT (0.33) | — | |
| SCHEMBL13873831 | 0.67 | CHRNB2 (0.39) | — | |
| SCHEMBL16162225 | 0.64 | GRM2 (0.37) | — | |
| SCHEMBL18083243 | 0.64 | TLR4 (0.38) | — | |
| SCHEMBL570733 | 0.64 | KCNH2 (0.37) | — | |
| Maleic Acid SCHEMBL17184313 | 0.63 | CHRNB2 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2402375-A1 | POLYOLEFIN COPOLYMER, AQUEOUS DISPERSION USING SAID POLYOLEFIN COPOLYMER AND MANUFACTURING METHOD THEREFOR, AND LAMINATE USING SAID POLYOLEFIN COPOLYMER | Unitika, Ltd. (JP) | 2012-01-04 | — | — | EP | disclosed |