⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL128836 | 0.93 | NAAA (0.65) | — | |
| SCHEMBL296867 | 0.91 | NAAA (0.69) | — | |
| SCHEMBL7843054 | 0.91 | NAAA (0.69) | — | |
| SCHEMBL7839868 | 0.91 | NAAA (0.69) | — | |
| SCHEMBL130965 | 0.91 | NAAA (0.69) | — | |
| SCHEMBL15953232 | 0.91 | NAAA (0.69) | — | |
| SCHEMBL50266 | 0.85 | — | — | |
| SCHEMBL50185 | 0.85 | NAAA (0.81) | — | |
| SCHEMBL2600809 | 0.85 | NAAA (0.73) | — | |
| SCHEMBL195856 | 0.83 | FAAH (0.49) | — |
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 411 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100471856-C | Bicyclic compounds and compostions as PDF inhibitors | IRM LLC (BM) | 2009-03-25 | — | — | CN | claimed |
| EP-1651643-A4 | BICYCLIC COMPOUNDS AND COMPOSITIONS AS PDF INHIBITORS | IRM LLC (BM) | 2008-10-08 | — | — | EP | claimed |
| US-20080214660-A1 | Compounds and Methods for the Inhibition of the Expression of VCAM-1 | CRABTREE ACQUISITION CO, LLC | 2008-09-04 | — | — | US | claimed |
| US-7378548-B2 | Tertiary amine compounds having an ester structure and processes for preparing the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2008-05-27 | — | — | US | claimed |
| US-20070259852-A1 | BICYCLIC COMPOUNDS AND COMPOSITIONS AS PDF INHIBITORS | IRM LLC | 2007-11-08 | — | — | US | claimed |
| US-7253164-B2 | Bicyclic compounds and compositions as PDF inhibitors | IRM LLC (BM) | 2007-08-07 | — | — | US | claimed |
| EP-1726582-A2 | Compounds and methods for the inhibition of the expression of vcam-1 | Atherogenics, Inc. (US) | 2006-11-29 | — | — | EP | claimed |
| CN-1860116-A | Bicyclic compounds and compostions as pdf inhibitors | IRM LLC (BM) | 2006-11-08 | — | — | CN | claimed |
| US-20060217570-A1 | Novel Tertiary Amine Compounds Having An Ester Structure And Processes For Preparing The Same | SHIN-ETSU CHEMICAL CO., LTD. | 2006-09-28 | — | — | US | claimed |
| EP-1695959-A1 | Compouds and methods for the inhibition of the expression of VCAM-1 | Atherogenics, Inc. (US) | 2006-08-30 | — | — | EP | claimed |
| EP-0827988-B1 | Mixtures of disperse dyes | DYSTAR TEXTILFARBEN GMBH & CO (DE) | 2001-12-05 | — | — | EP | claimed |
| EP-1099729-A2 | Mixtures of dispersive monoazo dyestuffs | DyStar Textilfarben GmbH & Co. Deutschland KG (DE) | 2001-05-16 | — | — | EP | claimed |
| EP-0994853-A2 | COMPOUNDS AND METHODS FOR THE INHIBITION OF THE EXPRESSION OF VCAM-1 | Atherogenics, Inc. (US) | 2000-04-26 | — | — | EP | claimed |
| US-5910624-A | DYEING HYDROPHOBIC FIBERS; COLORFASTNESS | DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) | 1999-06-08 | — | — | US | claimed |
| WO-1998051662-A2 | COMPOUNDS AND METHODS FOR THE INHIBITION OF THE EXPRESSION OF VCAM-1 | ATHEROGENICS, INC. (US) | 1998-11-19 | — | — | WO | claimed |
| EP-0827988-A1 | Mixtures of disperse dyes | DyStar Textilfarben GmbH & Co. Deutschland KG (DE) | 1998-03-11 | — | — | EP | claimed |
| EP-0267740-A1 | Naphthyridine and pyridopyrazine compounds and pharmaceutical usage thereof | SCHERING CORPORATION (US) | 1988-05-18 | — | — | EP | claimed |
| US-4628055-A | ASTHMA, BRONCHITIS, 1,5,8-AZANAPHTHYRIDINES | SCHERING CORPORATION (US) | 1986-12-09 | — | — | US | claimed |
| US-4492702-A | ATIALLERGENS, LUNG DISEASES | SCHERING CORPORATION (US) | 1985-01-08 | — | — | US | claimed |
| US-4094683-A | HETEROCYCLIC QUATERNARY AMMONIUM COMPOUND AS FOGGING AGENT | FUJI PHOTO FILM CO., LTD. (JA) | 1978-06-13 | — | — | US | claimed |