⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3709111 | 0.69 | — | — | |
| SCHEMBL3720045 | 0.61 | HSD11B1 (0.37) | — | |
| SCHEMBL3071065 | 0.59 | EPHX1 (0.30) | — | |
| SCHEMBL10804209 | 0.58 | L3MBTL1 (0.40) | — | |
| SCHEMBL8534730 | 0.57 | SMN1; SMN2 (0.49) | — | |
| SCHEMBL3720049 | 0.57 | HSD11B1 (0.36) | — | |
| SCHEMBL12986784 | 0.57 | EPHX1 (0.30) | — | |
| SCHEMBL2945480 | 0.57 | EPHX1 (0.43) | — | |
| SCHEMBL379857 | 0.57 | EPHX1 (0.43) | — | |
| SCHEMBL379856 | 0.57 | EPHX1 (0.43) | — |
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-2010091411-A1 | PIPERIDINYL CYCLIC AMIDO ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2010-08-12 | — | — | WO | disclosed |