⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3144917 | 0.93 | — | — | |
| SCHEMBL13298052 | 0.90 | FLT3 (0.30) | — | |
| SCHEMBL676852 | 0.88 | CRHR1 (0.36) | — | |
| SCHEMBL10405099 | 0.88 | — | — | |
| SCHEMBL3141029 | 0.87 | ADH1C (0.31) | — | |
| SCHEMBL3142119 | 0.87 | ADH1C (0.31) | — | |
| SCHEMBL13415289 | 0.87 | ADH1C (0.31) | — | |
| SCHEMBL13606378 | 0.86 | CRHR1 (0.35) | — | |
| SCHEMBL8603577 | 0.86 | DHFR (0.30) | — | |
| SCHEMBL376925 | 0.86 | — | — |
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-2207848-A2 | PROCESS FOR PRODUCING HIGH MOLECULAR WEIGHT POLYETHYLENE | DSM IP Assets B.V. (NL) | 2010-07-21 | — | — | EP | disclosed |
| WO-2009060043-A2 | PROCESS FOR PRODUCING HIGH MOLECULAR WEIGHT POLYETHYLENE | DSM IP ASSETS BV (NL) | 2009-05-14 | — | — | WO | disclosed |