⚠ 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 | |
|---|---|---|---|---|
| Ethoxycarbonyl Group SCHEMBL28015510 | 0.81 | NOTUM (0.31) | — | |
| Ethoxycarbonyl Group SCHEMBL28300783 | 0.79 | TSHR (0.31) | — | |
| SCHEMBL943970 | 0.74 | — | — | |
| Ethoxycarbonyl Group SCHEMBL28826450 | 0.71 | NOTUM (0.47) | — | |
| Ethoxycarbonyl Group SCHEMBL28826453 | 0.71 | NOTUM (0.48) | — | |
| Ethoxycarbonyl Group SCHEMBL29082677 | 0.71 | NOTUM (0.47) | — | |
| Ethoxycarbonyl Group SCHEMBL27865983 | 0.69 | LMNA (0.35) | — | |
| Pyrazine SCHEMBL27608305 | 0.68 | KMT2A (0.31) | — | |
| Ethoxycarbonyl Group SCHEMBL27405664 | 0.67 | — | — | |
| Ethoxycarbonyl Group SCHEMBL453 | 0.67 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114591686-A | Copper barrier layer chemical mechanical polishing solution and application thereof | 万华化学集团电子材料有限公司 | 2022-06-07 | — | — | CN | claimed |
| CN-114591686-B | Copper barrier layer chemical mechanical polishing solution and application thereof | 万华化学集团电子材料有限公司 | 2023-05-26 | — | — | CN | disclosed |
| CN-114591686-A | Copper barrier layer chemical mechanical polishing solution and application thereof | 万华化学集团电子材料有限公司 | 2022-06-07 | — | — | CN | disclosed |
| CN-105408325-B | cyanotriazole compounds | 大塚制药株式会社 | 2019-10-22 | — | — | CN | disclosed |
| CN-109923111-A | ANTIBIOTIC COMPOUNDS | 迪斯库瓦有限公司 | 2019-06-21 | — | — | CN | disclosed |
| CN-109890822-A | INHIBITORS OF CELLULAR METABOLIC PROCESSES | 安吉奥斯医药品有限公司 | 2019-06-14 | — | — | CN | disclosed |
| CN-101146802-A | Thiadiazole-substituted coumarin derivatives and their use as leukotriene biosynthesis inhibitors | MERCK FROSST CANADA LTD (CA) | 2008-03-19 | — | — | CN | disclosed |