⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16914478 | 0.77 | CRBN (0.34) | — | |
| SCHEMBL7290529 | 0.70 | ALDH1A1 (0.34) | — | |
| SCHEMBL4856995 | 0.70 | — | — | |
| SCHEMBL30599677 | 0.65 | — | — | |
| SCHEMBL11691562 | 0.65 | — | — | |
| SCHEMBL22470021 | 0.64 | ALDH1A1 (0.33) | — | |
| SCHEMBL3400810 | 0.64 | TRIM24 (0.40) | — | |
| SCHEMBL537099 | 0.64 | ALDH1A1 (0.33) | — | |
| SCHEMBL3815762 | 0.64 | TRIM24 (0.40) | — | |
| SCHEMBL8837715 | 0.64 | TRIM24 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230219946-A1 | PYRIMIDIN-4(3H)-ONE HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL USE THEREOF | BEIJING INNOCARE PHARMA TECH CO., LTD. (CN) | 2023-07-13 | — | — | US | disclosed |
| US-20170102618-A1 | METHOD OF FORMING PATTERN | FUJIFILM CORPORATION (JP) | 2017-04-13 | — | — | US | disclosed |
| US-20170102618-A1 | METHOD OF FORMING PATTERN | FUJIFILM CORPORATION (JP) | 2017-04-13 | — | — | US | disclosed |