⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL284681 | 0.82 | — | — | |
| SCHEMBL28274208 | 0.81 | — | — | |
| SCHEMBL7176331 | 0.80 | — | — | |
| SCHEMBL29105144 | 0.79 | CA12 (0.45) | — | |
| Hydrochloric Acid SCHEMBL10804922 | 0.78 | KDM4E (0.53) | — | |
| Hydrochloric Acid SCHEMBL28112622 | 0.78 | KDM4E (0.53) | — | |
| SCHEMBL28081155 | 0.75 | — | — | |
| SCHEMBL237209 | 0.73 | — | — | |
| SCHEMBL23791605 | 0.72 | — | — | |
| SCHEMBL13702622 | 0.72 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110099682-A | Coupled connector, cell binding molecule-drug conjugate containing same, and preparation and application thereof | 杭州多禧生物科技有限公司 | 2019-08-06 | — | — | CN | claimed |
| EP-1836535-A1 | NON-AQUEOUS, NON-CORROSIVE MICROELECTRONIC CLEANING COMPOSITIONS | Mallinckrodt Baker, Inc. (US) | 2007-09-26 | — | — | EP | claimed |
| WO-2006062534-A1 | NON-AQUEOUS, NON-CORROSIVE MICROELECTRONIC CLEANING COMPOSITIONS | MALLINCKRODT BAKER, INC. (US) | 2006-06-15 | — | — | WO | claimed |
| US-11247998-B2 | Piperazine heteroaryl derivative, preparation method therefor and use of same in medicine | JIANGSU HENGRUI MEDICINE CO., LTD. (CN) | 2022-02-15 | — | — | US | disclosed |
| CN-107847588-B | Molecular construct with targeting and effector moieties and uses thereof | 免疫功坊股份有限公司 | 2021-12-28 | — | — | CN | disclosed |
| US-20200157111-A1 | PIPERAZINE HETEROARYL DERIVATIVE, PREPARATION METHOD THEREFOR AND USE OF SAME IN MEDICINE | JIANGSU HENGRUI MEDICINE CO., LTD. (CN) | 2020-05-21 | — | — | US | disclosed |