⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL721180 | 0.70 | — | — | |
| SCHEMBL174801 | 0.69 | — | — | |
| Butane SCHEMBL16500599 | 0.67 | — | — | |
| SCHEMBL28861155 | 0.65 | — | — | |
| SCHEMBL2807684 | 0.65 | — | — | |
| SCHEMBL31135791 | 0.64 | — | — | |
| Hexadecane SCHEMBL12473013 | 0.64 | — | — | |
| SCHEMBL31135792 | 0.64 | — | — | |
| Decane SCHEMBL29555442 | 0.64 | — | — | |
| N-Propyl Bromide SCHEMBL795887 | 0.61 | — | — |
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-1397327-A2 | DEUTERATED N-SUBSTITUTED AND $g(a)-SUBSTITUTED DIPHENYLALKOXY ACETIC ACID AMINO ALKYL ESTERS AND MEDICAMENTS CONTAINING THESE COMPOUNDS | Turicum Drug Development AG (CH) | 2004-03-17 | — | — | EP | claimed |
| WO-2002102743-A2 | DEUTERATED N-SUBSTITUTED AND α-SUBSTITUTED DIPHENYLALKOXY ACETIC ACID AMINO ALKYL ESTERS AND MEDICAMENTS CONTAINING THESE COMPOUNDS | TURICUM DRUG DEVELOPMENT AG (CH) | 2002-12-27 | — | — | WO | claimed |