⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22964563 | 0.78 | KDM4E (0.32) | — | |
| SCHEMBL20329949 | 0.73 | — | — | |
| SCHEMBL6656278 | 0.72 | ALOX15 (0.36) | — | |
| SCHEMBL20317544 | 0.72 | GRIN2D (0.31) | — | |
| SCHEMBL9611073 | 0.72 | ALOX15 (0.36) | — | |
| SCHEMBL21933930 | 0.71 | ATM (0.39) | — | |
| SCHEMBL15248832 | 0.71 | GRIN2D (0.39) | — | |
| SCHEMBL278410 | 0.71 | GRIN2D (0.39) | — | |
| SCHEMBL6663337 | 0.71 | GRIN2D (0.39) | — | |
| SCHEMBL19542912 | 0.71 | GRIN2D (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10227347-B2 | Purinyl-N-hydroxyl pyrimidine formamide derivative, preparation methods and uses thereof | GUIZHOU BAILING GROUP PHARMACEUTICAL CO., LTD. (CN) | 2019-03-12 | — | — | US | disclosed |
| US-20180134709-A1 | PURINYL-N-HYDROXYL PYRIMIDINE FORMAMIDE DERIVATIVE, PREPARATION METHODS AND USES THEREOF | CHENGDU ZENITAR BIOMEDICAL TECHNOLOGY CO., LTD. (CN) | 2018-05-17 | — | — | US | disclosed |