⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15163589 | 0.72 | — | — | |
| SCHEMBL1247090 | 0.71 | — | — | |
| SCHEMBL22261784 | 0.67 | — | — | |
| SCHEMBL28709020 | 0.67 | — | — | |
| SCHEMBL666387 | 0.65 | — | — | |
| SCHEMBL2851896 | 0.63 | — | — | |
| SCHEMBL16689081 | 0.61 | ALDH1A1 (0.38) | — | |
| SCHEMBL24498119 | 0.58 | — | — | |
| SCHEMBL16635539 | 0.58 | — | — | |
| SCHEMBL24596368 | 0.58 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115536656-A | Heterocyclic compounds as HPK1 inhibitors | 杭州英创医药科技有限公司 | 2022-12-30 | — | — | CN | disclosed |
| CN-115362003-A | Diacylglycerol kinase modulating compounds | 卡尔那生物科学株式会社 | 2022-11-18 | — | — | CN | disclosed |
| CN-107207487-B | Compounds, compositions and methods for increasing CFTR activity | 蛋白质平衡治疗股份有限公司 | 2021-12-28 | — | — | CN | disclosed |
| CN-112585132-A | Proteasome activity enhancing compounds | 蛋白质平衡治疗股份有限公司 | 2021-03-30 | — | — | CN | disclosed |