⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL21597897 | 0.97 | — | — | |
| SCHEMBL28816891 | 0.85 | AKT1 (0.33) | — | |
| SCHEMBL13197731 | 0.78 | — | — | |
| SCHEMBL5473302 | 0.76 | — | — | |
| SCHEMBL27968687 | 0.76 | — | — | |
| SCHEMBL11651484 | 0.76 | KDM4E (0.35) | — | |
| SCHEMBL1803265 | 0.76 | — | — | |
| SCHEMBL28569938 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL7818338 | 0.75 | CA12 (0.40) | — | |
| SCHEMBL27443205 | 0.74 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104086460-B | Synthesis method of tert-butyl 2-(methylamino)ethylcarbamate | SUZHOU HIGHFINE BIOTECH CO LTD | 2015-06-03 | — | — | CN | claimed |
| CN-116589435-A | Ionizable lipids and compositions thereof for nucleic acid delivery | 成都威斯津生物医药科技有限公司 | 2023-08-15 | — | — | CN | disclosed |
| CN-109879780-B | Preparation method of (2-methylamine-ethyl) -tert-butyl carbamate | 上海卡洛化学有限公司 | 2021-06-29 | — | — | CN | disclosed |
| CN-109879780-A | A kind of preparation method of (2- methylamine-ethyl)-t-butyl carbamate | 上海卡洛化学有限公司 | 2019-06-14 | — | — | CN | disclosed |
| CN-107917903-A | Application of the glycosyl low-dimensional materials in influenza A virus fluoroscopic examination | 华东理工大学 | 2018-04-17 | — | — | CN | disclosed |
| CN-107835811-A | Anilinopyrimidine derivatives and uses thereof | 正大天晴药业集团股份有限公司 | 2018-03-23 | — | — | CN | disclosed |
| WO-2017072341-A1 | PYRIMIDONE DERIVATIVES AND THEIR USE IN THE TREATMENT, AMELIORATION OR PREVENTION OF A VIRAL DISEASE | F. HOFFMANN-LA ROCHE AG (CH) | 2017-05-04 | — | — | WO | disclosed |
| CN-106279352-A | The derivant of aplysiatoxin 10 and application thereof | 上海新理念生物医药科技有限公司 | 2017-01-04 | — | — | CN | disclosed |
| CN-104781246-A | Fluorescent chemical dyes for visualizing symmetric and asymmetric division of neural stem cells | UNIV SINGAPORE | 2015-07-15 | — | — | CN | disclosed |
| CN-104755459-A | Fluoromethyl-substituted pyrrolecarboxamides | GRUENENTHAL CHEMIE | 2015-07-01 | — | — | CN | disclosed |
| CN-104086460-B | Synthesis method of tert-butyl 2-(methylamino)ethylcarbamate | SUZHOU HIGHFINE BIOTECH CO LTD | 2015-06-03 | — | — | CN | disclosed |
| CN-104661683-A | Immunomodulatory conjugates | ASCEND BIOPHARMACEUTICALS PTY LTD | 2015-05-27 | — | — | CN | disclosed |
| EP-1888584-A1 | 1, 6 -DIHYDRO- 1,3, 5, 6-TETRAAZA-AS-INDACENE BASED TRICYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME AS INHIBITORS OF IKK ENZYME ACTIVITY | Brystol-Myers Squibb Company (US) | 2008-02-20 | — | — | EP | disclosed |
| WO-2006122137-A1 | 1, 6 -DIHYDRO- 1,3, 5, 6-TETRAAZA-AS-INDACENE BASED TRICYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME AS INHIBITORS OF IKK ENZYME ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-11-16 | — | — | WO | disclosed |