⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4418206 | 0.81 | NPC1 (0.38) | — | |
| SCHEMBL702526 | 0.79 | TSHR (0.53) | — | |
| SCHEMBL30102300 | 0.79 | TSHR (0.57) | — | |
| SCHEMBL4865789 | 0.79 | TSHR (0.57) | — | |
| SCHEMBL10813090 | 0.79 | TSHR (0.57) | — | |
| SCHEMBL4394449 | 0.78 | TRPA1 (0.44) | — | |
| SCHEMBL12324597 | 0.78 | TSHR (0.52) | — | |
| SCHEMBL14253086 | 0.78 | TSHR (0.52) | — | |
| SCHEMBL1485845 | 0.74 | — | — | |
| SCHEMBL4725712 | 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 495 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230338297-A1 | Encapsulated Agents that Bind to MCT-1 | THE JOHNS HOPKINS UNIVERSITY | 2023-10-26 | — | — | US | claimed |
| EP-4210688-A1 | ENCAPSULATED AGENTS THAT BIND TO MCT-1 | The Johns Hopkins University (US) | 2023-07-19 | — | — | EP | claimed |
| CN-115304627-A | Polar boron-nitrogen luminescent material, application thereof and organic electroluminescent device comprising same | 清华大学 | 2022-11-08 | — | — | CN | claimed |
| US-20190328665-A1 | LIPOSOME COMPOSITIONS ENCAPSULATING MODIFIED CYCLODEXTRIN COMPLEXES AND USES THEREOF | UNIV JOHNS HOPKINS (US) | 2019-10-31 | — | — | US | claimed |
| US-20190328666-A1 | CYCLODEXTRIN COMPOSITIONS ENCAPSULATING A SELECTIVE ATP INHIBITOR AND USES THEREOF | UNIV JOHNS HOPKINS (US) | 2019-10-31 | — | — | US | claimed |
| EP-3094317-B1 | CYCLODEXTRIN COMPOSITIONS ENCAPSULATING A SELECTIVE ATP INHIBITOR AND USES THEREOF | UNIV JOHNS HOPKINS (US) | 2019-10-02 | — | — | EP | claimed |
| US-20180161274-A1 | Liposome Compositions Encapsulating Modified Cyclodextrin Complexes and Uses Thereof | UNIV JOHNS HOPKINS (US) | 2018-06-14 | — | — | US | claimed |
| US-9737487-B2 | Cyclodextrin compositions encapsulating a selective ATP inhibitor and uses thereof | THE JOHNS HOPKINS UNIVERSITY (US) | 2017-08-22 | — | — | US | claimed |
| EP-3094313-A1 | LIPOSOME COMPOSITIONS ENCAPSULATING MODIFIED CYCLODEXTRIN COMPLEXES AND USES THEREOF | The Johns Hopkins University (US) | 2016-11-23 | — | — | EP | claimed |
| EP-3094317-A1 | CYCLODEXTRIN COMPOSITIONS ENCAPSULATING A SELECTIVE ATP INHIBITOR AND USES THEREOF | The Johns Hopkins University (US) | 2016-11-23 | — | — | EP | claimed |
| US-5538950-A | PEPTIDE DERIVATIVES AS HYPOTENSIVE AGENTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-07-23 | — | — | US | claimed |
| EP-0621867-A1 | NEW ENDOTHELIN ANTAGONISTS AND THEIR PREPARATION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-11-02 | — | — | EP | claimed |
| EP-0472925-B1 | Substituted pyridins | BAYER AG (DE) | 1994-08-31 | — | — | EP | claimed |
| WO-1993010144-A1 | NEW ENDOTHELIN ANTAGONISTS AND THEIR PREPARATION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1993-05-27 | — | — | WO | claimed |
| US-4565639-A | USING CATIONIC FLUOROPOLYMERS | HALLIBURTON COMPANY (US) | 1986-01-21 | — | — | US | claimed |
| EP-0151833-A1 | Method of increasing hydrocarbon production by remedial well treatment | HALLIBURTON COMPANY (US) | 1985-08-21 | — | — | EP | claimed |
| US-4425242-A | CATIONIC FLUOROPOLYMERS, NONWETTING | HALLIBURTON COMPANY (US) | 1984-01-10 | — | — | US | claimed |
| US-4408043-A | POLYOXYALKYLENE HAVING FLUOROR AND CATIONIC NITROGEN GROUPS | NALCO CHEMICAL COMPANY (US) | 1983-10-04 | — | — | US | claimed |
| EP-0087709-A1 | N,N',N\"-triaryl-1,2,3-triaminopropane derivatives, process for their preparation and their use as intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-09-07 | — | — | EP | claimed |
| US-4049661-A | FIBER-REACTIVE | CIBA-GEIGY AG (CH) | 1977-09-20 | — | — | US | claimed |