⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20568928 | 1.00 | — | — | |
| SCHEMBL30698021 | 0.67 | CHEK1 (0.33) | — | |
| SCHEMBL27642723 | 0.65 | CREBBP (0.39) | — | |
| SCHEMBL13757115 | 0.65 | RIPK1 (0.39) | — | |
| SCHEMBL30277914 | 0.64 | MTAP (0.31) | — | |
| SCHEMBL12170631 | 0.64 | RET (0.47) | — | |
| SCHEMBL3587691 | 0.64 | — | — | |
| SCHEMBL9377605 | 0.61 | PDE3B (0.33) | — | |
| SCHEMBL6701988 | 0.59 | P2RX7 (0.45) | — | |
| SCHEMBL13330618 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-112601752-A | Novel inhibitors of MAP4K1 | 伊克诺斯科学公司 | 2021-04-02 | — | — | CN | disclosed |
| EP-3630778-A1 | NOVEL INHIBITORS OF MAP4K1 | Ichnos Sciences SA (CH) | 2020-04-08 | — | — | EP | disclosed |
| WO-2018215668-A1 | NOVEL INHIBITORS OF MAP4K1 | GLENMARK PHARMACEUTICALS S.A. (CH) | 2018-11-29 | — | — | WO | disclosed |