⚠ 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 | |
|---|---|---|---|---|
| Acetic Acid Methyl Ester SCHEMBL28738052 | 0.96 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL3080739 | 0.95 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL28296965 | 0.95 | ALDH1A1 (1.00) | — | |
| Acetic Acid Methyl Ester SCHEMBL3650 | 0.95 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL8322448 | 0.95 | ALDH1A1 (1.00) | — | |
| Acetic Acid Methyl Ester SCHEMBL23092253 | 0.91 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL2992111 | 0.91 | ALDH1A1 (0.91) | — | |
| Acetic Acid Methyl Ester SCHEMBL10544751 | 0.91 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL21591845 | 0.91 | — | — | |
| Acetic Acid Methyl Ester SCHEMBL147887 | 0.91 | — | — |
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-105047434-B | A kind of method that utilization gaseous penetration method prepares titanium oxide nanotubes/carbon/manganese oxide composite material | 哈尔滨工业大学 | 2017-09-26 | — | — | CN | claimed |
| CN-105047434-A | Method of preparing titania nanotube/carbon/manganese oxide composite material by using gaseous penetration method | HARBIN INST OF TECHNOLOGY | 2015-11-11 | — | — | CN | claimed |
| CN-115889800-A | Rare earth metal-containing porous core-shell nanosphere and preparation method thereof | 苏州大学 | 2023-04-04 | — | — | CN | disclosed |
| EP-2996677-B1 | PHOTOSENSITIZER PARTICLES FOR MEDICAL IMAGING AND/OR PHOTODYNAMIC THERAPY | UNIV NAT CHUNG HSING (TW) | 2019-11-20 | — | — | EP | disclosed |
| CN-107382849-A | A kind of post [5] aromatic hydrocarbons acylhydrazone class schiff base compounds and preparation method thereof | 扬州大学 | 2017-11-24 | — | — | CN | disclosed |
| CN-107365291-A | Oxa- cup [4] aromatic hydrocarbons list schiff bases, synthetic method and its application in copper ion identification | 扬州大学 | 2017-11-21 | — | — | CN | disclosed |
| CN-105047434-B | A kind of method that utilization gaseous penetration method prepares titanium oxide nanotubes/carbon/manganese oxide composite material | 哈尔滨工业大学 | 2017-09-26 | — | — | CN | disclosed |
| US-20160082127-A1 | PHOTOSENSITIZER PARTICLES FOR MEDICAL IMAGING AND/OR PHOTODYNAMIC THERAPY | NATIONAL CHUNG HSING UNIVERSITY (TW) | 2016-03-24 | — | — | US | disclosed |
| EP-2996677-A1 | PHOTOSENSITIZER PARTICLES FOR MEDICAL IMAGING AND/OR PHOTODYNAMIC THERAPY | DCB-USA LLC (US) | 2016-03-23 | — | — | EP | disclosed |
| CN-105307638-A | Photosensitive particles and application thereof in photodynamic therapy and development | XUE FUSHENG | 2016-02-03 | — | — | CN | disclosed |
| CN-105047434-A | Method of preparing titania nanotube/carbon/manganese oxide composite material by using gaseous penetration method | HARBIN INST OF TECHNOLOGY | 2015-11-11 | — | — | CN | disclosed |
| WO-2014189796-A1 | PHOTOSENSITIZER PARTICLES FOR MEDICAL IMAGING AND/OR PHOTODYNAMIC THERAPY | DCB-USA LLC (US) | 2014-11-27 | — | — | WO | disclosed |
| US-6695938-B2 | Reducing agent in solvent; reactive fuel reacts with hydrogen peroxide oxidizer; high speed ignition | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY | 2004-02-24 | — | — | US | disclosed |
| US-20030192633-A1 | Reduced toxicity hypergolic bipropellant fuels | NAVY, UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE | 2003-10-16 | — | — | US | disclosed |