⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7945196 | 0.97 | — | — | |
| SCHEMBL28770045 | 0.78 | — | — | |
| SCHEMBL7167311 | 0.76 | ALDH1A1 (0.32) | — | |
| SCHEMBL1059686 | 0.67 | — | — | |
| SCHEMBL851701 | 0.67 | — | — | |
| SCHEMBL433119 | 0.67 | — | — | |
| SCHEMBL8335212 | 0.67 | — | — | |
| SCHEMBL5255304 | 0.67 | — | — | |
| SCHEMBL14010698 | 0.65 | — | — | |
| SCHEMBL2897799 | 0.61 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115551875-A | Systems and methods for tyrosinase-mediated site-specific protein conjugation | 基因泰克公司 | 2022-12-30 | — | — | CN | disclosed |
| CN-105054933-A | MR methods of grading a tumor using an imaging medium that comprises hyperpolarised 13c-pyruvate | UNIV CALIFORNIA | 2015-11-18 | — | — | CN | disclosed |
| CN-101027310-B | Radicals and their use as paramagnetic agents in DNP processes | GE HEALTHCARE AS | 2012-08-22 | — | — | CN | disclosed |
| US-8143063-B2 | Method for warning of radiological and chemical agents using detection paints on a vehicle surface | LAWRENCE LIVERMORE NATIONAL SECURITY, LLC (US) | 2012-03-27 | — | — | US | disclosed |
| US-8133735-B2 | Method for warning of radiological and chemical substances using detection paints on a vehicle surface | LAWRENCE LIVERMORE NATIONAL SECURITY, LLC (US) | 2012-03-13 | — | — | US | disclosed |
| US-20110008896-A1 | Paint for Detection of Radiological or Chemical Agents | U.S. DEPARTMENT OF ENERGY | 2011-01-13 | — | — | US | disclosed |
| US-20110008897-A1 | Paint for Detection Of Corrosion and Warning of Chemical and Radiological Attack | U.S. DEPARTMENT OF ENERGY | 2011-01-13 | — | — | US | disclosed |
| CN-101730504-A | Using involving hyperpolarisation13MR method for grading tumors with imaging medium of C-pyruvate | GEN ELECTRIC | 2010-06-09 | — | — | CN | disclosed |
| CN-101027310-A | Radicals and their use as paramagnetic agents in DNP processes | GE HEALTHCARE AS (NO) | 2007-08-29 | — | — | CN | disclosed |
| EP-1119249-A4 | METHOD TO MITIGATE PLANT STRESS | EMERALD BIOAGRICULTURE CORP (US) | 2001-11-14 | — | — | EP | disclosed |
| EP-1119249-A1 | METHOD TO MITIGATE PLANT STRESS | Auxein Corporation (US) | 2001-08-01 | — | — | EP | disclosed |
| WO-2000019821-A1 | METHOD TO MITIGATE PLANT STRESS | EMERALD BIOAGRICULTURE CORPORATION (US) | 2000-04-13 | — | — | WO | disclosed |
| US-4259507-A | ROAST PORK FLAVOR | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1981-03-31 | — | — | US | disclosed |