⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6846762 | 0.90 | MAPK1 (0.42) | — | |
| SCHEMBL4159314 | 0.87 | MAPK1 (0.48) | — | |
| SCHEMBL663341 | 0.84 | — | — | |
| SCHEMBL5128359 | 0.82 | — | — | |
| SCHEMBL6223853 | 0.81 | ALDH1A1 (0.46) | — | |
| SCHEMBL6846175 | 0.80 | — | — | |
| SCHEMBL25075398 | 0.78 | KDM4E (0.46) | — | |
| SCHEMBL5933233 | 0.77 | MAPK1 (0.43) | — | |
| SCHEMBL12721326 | 0.77 | TSHR (0.52) | — | |
| SCHEMBL5933722 | 0.77 | MAPK1 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6768024-B1 | CONTROLLING OBESITY, SEXUAL DYSFUNCTION OR INFLAMMATION | LION BIOSCIENCE AG (DE) | 2004-07-27 | — | — | US | claimed |
| WO-2002012166-A2 | TRIAMINE DERIVATIVE MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | LION BIOSCIENCE AG (DE) | 2002-02-14 | — | — | WO | claimed |
| US-10617618-B2 | Agent for oxidative dyeing of hair containing anisole derivatives | HENKEL AG & CO. KGAA (DE) | 2020-04-14 | — | — | US | disclosed |
| US-20190167551-A1 | AGENT FOR OXIDATIVE DYEING OF HAIR CONTAINING ANISOLE DERIVATIVES | HENKEL AG & CO. KGAA (DE) | 2019-06-06 | — | — | US | disclosed |
| US-9364408-B2 | Hair dye agent comprising aminopyrimidine derivatives | HENKEL AG & CO. KGAA (DE) | 2016-06-14 | — | — | US | disclosed |
| US-20150209258-A1 | HAIR DYE AGENT COMPRISING AMINOPYRIMIDINE DERIVATIVES | HENKEL AG & CO. KGAA (DE) | 2015-07-30 | — | — | US | disclosed |
| US-20080312273-A1 | Quinoline Derivatives Having Vegf Inhibiting Activity | HENNEQUIN LAURENT FRANCOIS ANDRE | 2008-12-18 | — | — | US | disclosed |
| US-6768024-B1 | CONTROLLING OBESITY, SEXUAL DYSFUNCTION OR INFLAMMATION | LION BIOSCIENCE AG (DE) | 2004-07-27 | — | — | US | disclosed |
| WO-2002012166-A2 | TRIAMINE DERIVATIVE MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | LION BIOSCIENCE AG (DE) | 2002-02-14 | — | — | WO | disclosed |
| CN-1075828-C | Organopolysiloxane compounds cross-linkable by cleaving of alcohols to form elastomers | WACHER CHEMIE GMBH (DE) | 2001-12-05 | — | — | CN | disclosed |
| US-6218498-B1 | USEFUL IN PREPARING MOISTURE CURABLE RTV-1 COMPOSITIONS, AND ARE USEFUL IN DIVERSE PROCESSES WHERE SCAVENGING OF PROTIC MATERIALS, PARTICULARLY WATER, IS DESIRED. | WACKER-CHEMIE GMBH (DE) | 2001-04-17 | — | — | US | disclosed |
| US-6011112-A | SILYLATED ORGANONITROGEN COMPOUNDS | WACKER-CHEMIE GMBH (DE) | 2000-01-04 | — | — | US | disclosed |
| CN-1193989-A | Organopolysiloxane compositions crosslinkable by elimination of alcohols to give elastomers | WACKER CHEMIE GMBH (DE) | 1998-09-23 | — | — | CN | disclosed |