⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL311876 | 0.85 | ALDH1A1 (0.53) | — | |
| SCHEMBL2706963 | 0.80 | ALDH1A1 (0.48) | — | |
| SCHEMBL342382 | 0.79 | GLO1 (0.32) | — | |
| SCHEMBL197897 | 0.78 | — | — | |
| SCHEMBL12814201 | 0.78 | — | — | |
| SCHEMBL713608 | 0.78 | — | — | |
| SCHEMBL21715100 | 0.76 | — | — | |
| SCHEMBL5171320 | 0.76 | ALDH1A1 (0.43) | — | |
| SCHEMBL4645361 | 0.76 | ALDH1A1 (0.43) | — | |
| SCHEMBL30662414 | 0.76 | — | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9896711-B2 | Fluorogenic or fluorophoric compounds and uses thereof | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2018-02-20 | — | — | US | disclosed |
| US-20160340709-A1 | FLUOROGENIC OR FLUOROPHORIC COMPOUNDS AND USES THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2016-11-24 | — | — | US | disclosed |
| US-9434975-B2 | Fluorogenic or fluorophoric compounds and uses thereof | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2016-09-06 | — | — | US | disclosed |
| US-9193740-B2 | Bismacrocyclic compounds as hepatitis C virus inhibitors | ENANTA PHARMACEUTICALS, INC. (US) | 2015-11-24 | — | — | US | disclosed |
| EP-2691383-B1 | FLUOROGENIC OR FLUOROPHORIC COMPOUNDS AND USES THEREOF | 3M INNOVATIVE PROPERTIES CO (US) | 2015-01-21 | — | — | EP | disclosed |
| US-20140186878-A1 | FLUOROGENIC OR FLUOROPHORIC COMPOUNDS AND USES THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2014-07-03 | — | — | US | disclosed |
| EP-2691383-A1 | FLUOROGENIC OR FLUOROPHORIC COMPOUNDS AND USES THEREOF | 3M Innovative Properties Company (US) | 2014-02-05 | — | — | EP | disclosed |
| WO-2012134724-A1 | FLUOROGENIC OR FLUOROPHORIC COMPOUNDS AND USES THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2012-10-04 | — | — | WO | disclosed |
| WO-2007065524-A1 | ERYTHRULOSE ESTERS AS UV FILTERS | MERCK PATENT GMBH (DE) | 2007-06-14 | — | — | WO | disclosed |
| EP-1009377-A4 | MEDICAL USES OF PYRUVATES | UNIV CASE WESTERN RESERVE (US) | 2004-01-21 | — | — | EP | disclosed |
| US-6086789-A | SKIN INJURIES | CASE WESTERN RESERVE UNIVERSITY (US) | 2000-07-11 | — | — | US | disclosed |
| EP-1009377-A1 | MEDICAL USES OF PYRUVATES | Case Western Reserve University (US) | 2000-06-21 | — | — | EP | disclosed |
| US-5968727-A | SOLUTION FOR LONG TERM PRESERVATION OF TRANSPLANTABLE ORGANS DEPRIVED OF OXYGEN | CASE WESTERN RESERVE UNIVERSITY (US) | 1999-10-19 | — | — | US | disclosed |
| US-5876916-A | ADMINISTRATION OF GLYCEROL-PYRUVATE OR HYDROXYACETONE PYRUVATE ESTER WITH BIOCOMPATIBLE CARRIER TO MAMMALS; AS HIGH CALORIE FOOD, ANTICHOLESTEROL AGENTS, ANTIISHEMIC AGENTS, ORGAN PRESERVATIVE, ANTIDIABETIC AGENTS | CASE WESTERN RESERVE UNIVERSITY (US) | 1999-03-02 | — | — | US | disclosed |
| EP-0888267-A1 | NOVEL PYRUVATE COMPOUNDS AND METHODS FOR USE THEREOF | CASE WESTERN RESERVE UNIVERSITY (US) | 1999-01-07 | — | — | EP | disclosed |
| WO-1998051277-A1 | MEDICAL USES OF PYRUVATES | CASE WESTERN RESERVE UNIVERSITY (US) | 1998-11-19 | — | — | WO | disclosed |
| WO-1997034856-A1 | NOVEL PYRUVATE COMPOUNDS AND METHODS FOR USE THEREOF | CASE WESTERN RESERVE UNIVERSITY (US) | 1997-09-25 | — | — | WO | disclosed |
| US-4957912-A | ANTIBIOTICS | MERCK & CO., INC. (US) | 1990-09-18 | — | — | US | disclosed |
| US-4226866-A | BACTERICIDES, ACYLATION | MERCK & CO., INC. (US) | 1980-10-07 | — | — | US | disclosed |