⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29365624 | 0.84 | MAPT (0.32) | — | |
| SCHEMBL135939 | 0.84 | MAPT (0.32) | — | |
| Hydrochloric Acid SCHEMBL2833170 | 0.83 | MAPT (0.32) | — | |
| SCHEMBL369069 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL3918262 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL133552 | 0.77 | BACE1 (0.30) | — | |
| SCHEMBL16699727 | 0.77 | BACE1 (0.30) | — | |
| SCHEMBL1535723 | 0.76 | BACE1 (0.31) | — | |
| SCHEMBL21552516 | 0.76 | — | — | |
| SCHEMBL15612708 | 0.74 | HPGD (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 |
|---|---|---|---|---|---|---|---|
| WO-2013158225-A1 | POLYOLEFIN COMPOSITIONS AND METHODS OF PRODUCTION THEREOF | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2013-10-24 | — | — | WO | disclosed |