⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12120976 | 0.80 | — | — | |
| SCHEMBL1876548 | 0.78 | — | — | |
| SCHEMBL20652493 | 0.78 | — | — | |
| SCHEMBL11930640 | 0.78 | — | — | |
| SCHEMBL27394937 | 0.76 | CASP2 (0.47) | — | |
| SCHEMBL11573312 | 0.76 | EPHX1 (0.33) | — | |
| SCHEMBL16675567 | 0.75 | PHF8 (0.45) | — | |
| SCHEMBL15443885 | 0.75 | HPGD (0.39) | — | |
| SCHEMBL4804259 | 0.74 | — | — | |
| SCHEMBL85842 | 0.74 | — | — |
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-3187498-A1 | AZAINDOLE DERIVATIVE HAVING AMPK-ACTIVATING EFFECT | Shionogi & Co., Ltd. (JP) | 2017-07-05 | — | — | EP | disclosed |
| WO-2009134469-A1 | UNNATURAL POLYMERASE SUBSTRATES THAT CAN SUSTAIN ENZYMATIC SYNTHESIS OF DOUBLE STRANDED NUCLEIC ACIDS FROM A NUCLEIC ACID TEMPLATE AND METHODS OF USE | LIFE TECHNOLOGIES (US) | 2009-11-05 | — | — | WO | disclosed |