⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29883 | 1.00 | — | — | |
| SCHEMBL19006673 | 0.91 | — | — | |
| Beta-Citronellene SCHEMBL9066753 | 0.87 | TSHR (0.40) | — | |
| SCHEMBL6651983 | 0.86 | MEN1 (0.33) | — | |
| SCHEMBL14481257 | 0.86 | — | — | |
| SCHEMBL4234013 | 0.84 | PTPN1 (0.31) | — | |
| SCHEMBL6653698 | 0.84 | CES1 (0.30) | — | |
| SCHEMBL31512393 | 0.80 | ALDH1A1 (0.38) | — | |
| SCHEMBL9858220 | 0.80 | — | — | |
| SCHEMBL8024948 | 0.80 | — | — |
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-2190918-A1 | FILLED TPO COMPOSITIONS WITH GOOD LOW TEMPERATURE DUCTILITY | Dow Global Technologies Inc. (US) | 2010-06-02 | — | — | EP | disclosed |
| WO-2009035850-A1 | FILLED TPO COMPOSITIONS WITH GOOD LOW TEMPERATURE DUCTILITY | DOW GLOBAL TECHNOLOGIES INC. (US) | 2009-03-19 | — | — | WO | disclosed |