⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12389945 | 0.88 | — | — | |
| SCHEMBL17850691 | 0.87 | ACACB (0.30) | — | |
| SCHEMBL15277097 | 0.86 | — | — | |
| SCHEMBL15076435 | 0.82 | PIM1 (0.33) | — | |
| SCHEMBL12199296 | 0.82 | — | — | |
| SCHEMBL14677605 | 0.82 | — | — | |
| SCHEMBL15806855 | 0.80 | SLC6A2 (0.32) | — | |
| SCHEMBL14676314 | 0.78 | ACACB (0.32) | — | |
| SCHEMBL16080652 | 0.77 | NSD2 (0.38) | — | |
| SCHEMBL16080653 | 0.77 | NSD2 (0.38) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2429568-B1 | MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS | ENANTA PHARM INC (US) | 2016-08-17 | — | — | EP | disclosed |
| CN-105073745-A | Glucosylceramide synthase inhibitors | GENZYME CORP | 2015-11-18 | — | — | CN | disclosed |
| US-8047638-B2 | Liquid ejecting apparatus | KONICA MINOLTA HOLDINGS, INC. (JP) | 2011-11-01 | — | — | US | disclosed |
| WO-2010132163-A1 | MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS | ENANTA PHARMACEUTICALS, INC. (US) | 2010-11-18 | — | — | WO | disclosed |
| US-20090079794-A1 | LIQUID EJECTING APPARATUS | KONICA MINOLTA HOLDINGS, INC. (JP) | 2009-03-26 | — | — | US | disclosed |
| CN-101151247-A | 3,4, 5-substituted piperidines as renin inhibitors | SPEEDEL EXPERIMENTA AG (CH) | 2008-03-26 | — | — | CN | disclosed |