⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL183127 | 0.70 | — | — | |
| SCHEMBL11414250 | 0.57 | HCAR2 (0.53) | — | |
| SCHEMBL126515 | 0.56 | — | — | |
| SCHEMBL11510268 | 0.54 | CTSD (0.32) | — | |
| SCHEMBL19966074 | 0.54 | — | — | |
| Hydrochloric Acid SCHEMBL7934712 | 0.54 | — | — | |
| SCHEMBL15840943 | 0.53 | — | — | |
| Hydrochloric Acid SCHEMBL7527537 | 0.53 | — | — | |
| SCHEMBL10715334 | 0.53 | — | — | |
| SCHEMBL842559 | 0.50 | — | — |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104507948-B | Method for producing nitrogenated heterocyclic N-oxide compound | 日产化学工业株式会社 | 2017-05-03 | — | — | CN | claimed |
| CN-105377826-A | Process for producing heterocyclic compound | NISSAN CHEMICAL IND LTD | 2016-03-02 | — | — | CN | claimed |
| CN-104507948-A | Method for producing nitrogenated heterocyclic N-oxide compound | NISSAN CHEMICAL IND LTD | 2015-04-08 | — | — | CN | claimed |
| CN-101068817-A | Novel thienopyridinepyrimidine derivatives | ALMIRALL LAB S A (ES) | 2007-11-07 | — | — | CN | claimed |
| US-11033516-B1 | Combination therapies with disulfiram | Spring Discovery, Inc. (US) | 2021-06-15 | — | — | US | disclosed |
| CN-105121410-B | Herbicidally active 2- (substituted-phenyl) -cyclopentane-1, 3-dione compounds and derivatives thereof | SYNGENTA LTD. (GB) | 2019-11-01 | — | — | CN | disclosed |
| CN-106795101-B | Herbicides compounds | 先正达参股股份有限公司 | 2019-09-20 | — | — | CN | disclosed |
| CN-105283446-B | Herbicidally active 2- (substituted-phenyl) -cyclopentane-1, 3-dione compounds and derivatives thereof | 先正达有限公司 | 2018-06-12 | — | — | CN | disclosed |
| CN-104870430-B | Herbicidally active cyclic dione compounds substituted by phenyl groups having alkynyl-containing substituents or derivatives thereof | 先正达有限公司 | 2018-05-29 | — | — | CN | disclosed |
| CN-104507949-B | The manufacture method of the nitrogen-containing heterocycle compound of high-purity | 日产化学工业株式会社 | 2017-07-28 | — | — | CN | disclosed |
| CN-104507948-B | Method for producing nitrogenated heterocyclic N-oxide compound | 日产化学工业株式会社 | 2017-05-03 | — | — | CN | disclosed |
| CN-105377826-A | Process for producing heterocyclic compound | NISSAN CHEMICAL IND LTD | 2016-03-02 | — | — | CN | disclosed |
| CN-104507948-A | Method for producing nitrogenated heterocyclic N-oxide compound | NISSAN CHEMICAL IND LTD | 2015-04-08 | — | — | CN | disclosed |
| CN-104507949-A | Method for producing nitrogen-containing heterocyclic compound of high purity | NISSAN CHEMICAL IND LTD | 2015-04-08 | — | — | CN | disclosed |
| CN-1934116-B | Tricyclic benzopyran compounds useful as antiarrhythmic agents | NISSAN CHEMICAL IND LTD | 2012-10-10 | — | — | CN | disclosed |
| CN-101429200-B | Tricyclic benzopyran compound as anti-arrhythmic agents | NISSAN CHEMICAL IND LTD | 2012-05-30 | — | — | CN | disclosed |
| CN-101263144-A | New pyrido[3',2':4,5]furo[3,2-d]pyrimidine derivatives | ALMIRALL LAB (ES) | 2008-09-10 | — | — | CN | disclosed |
| CN-101068817-A | Novel thienopyridinepyrimidine derivatives | ALMIRALL LAB S A (ES) | 2007-11-07 | — | — | CN | disclosed |
| EP-1534724-A2 | MONOCYCLOPENTADIENYL COMPLEXES | Basell Polyolefine GmbH (DE) | 2005-06-01 | — | — | EP | disclosed |
| WO-2004020479-A2 | MONOCYCLOPENTADIENYL COMPLEXES | BASELL POLYOLEFINE GMBH (DE) | 2004-03-11 | — | — | WO | disclosed |