⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6843569 | 0.83 | NPC1 (0.30) | — | |
| SCHEMBL5853725 | 0.81 | — | — | |
| SCHEMBL6836068 | 0.80 | POLB (0.31) | — | |
| SCHEMBL6859344 | 0.80 | LMNA (0.31) | — | |
| SCHEMBL6843688 | 0.80 | — | — | |
| SCHEMBL217386 | 0.79 | HTR6 (0.31) | — | |
| SCHEMBL5853704 | 0.79 | — | — | |
| SCHEMBL6837862 | 0.79 | SIGMAR1 (0.34) | — | |
| SCHEMBL5854316 | 0.78 | ATM (0.32) | — | |
| SCHEMBL6694765 | 0.78 | BCHE (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-2004106394-A1 | COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2004-12-09 | — | — | WO | disclosed |