⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15177329 | 0.77 | — | — | |
| SCHEMBL9003691 | 0.65 | — | — | |
| SCHEMBL13085175 | 0.65 | PNMT (0.31) | — | |
| SCHEMBL17586306 | 0.61 | CA1 (0.32) | — | |
| SCHEMBL30510464 | 0.57 | — | — | |
| SCHEMBL10151919 | 0.57 | PNMT (0.32) | — | |
| SCHEMBL1903771 | 0.57 | PNMT (0.40) | — | |
| SCHEMBL25274508 | 0.56 | — | — | |
| SCHEMBL8796120 | 0.56 | — | — | |
| SCHEMBL31263657 | 0.56 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8507493-B2 | Amide and amidine derivatives and uses thereof | ABBVIE INC. (US) | 2013-08-13 | — | — | US | disclosed |
| EP-2243479-A2 | Novel amide and amidine derivates and uses thereof | Abbott Laboratories (US) | 2010-10-27 | — | — | EP | disclosed |
| US-20100267738-A1 | NOVEL AMIDE AND AMIDINE DERIVATIVES AND USES THEREOF | ABBOTT LABORATORIES (US) | 2010-10-21 | — | — | US | disclosed |