⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2003497 | 0.80 | — | — | |
| SCHEMBL22047557 | 0.77 | TBXAS1 (0.42) | — | |
| Formic Acid SCHEMBL29128942 | 0.76 | ALDH1A1 (0.41) | — | |
| SCHEMBL618874 | 0.75 | ALDH1A1 (0.43) | — | |
| SCHEMBL1325 | 0.75 | FAAH (0.45) | — | |
| SCHEMBL15846673 | 0.75 | FAAH (0.45) | — | |
| SCHEMBL25507662 | 0.75 | CYP26A1 (0.36) | — | |
| SCHEMBL6558961 | 0.73 | — | — | |
| Hydrogen Sulfide SCHEMBL10814521 | 0.73 | FAAH (0.44) | — | |
| SCHEMBL10814524 | 0.73 | FAAH (0.44) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103221409-B | Herbicidal benzoxazinones | BASF SE (DE) | 2016-03-09 | — | — | CN | disclosed |
| CN-102015706-B | Imidazolidinone derivatives as 11B-HSD1 inhibitors | HOFFMANN LA ROCHE | 2014-07-16 | — | — | CN | disclosed |
| CN-102015706-A | Imidazolidinone derivatives as 11B-HSD1 inhibitors | HOFFMANN LA ROCHE | 2011-04-13 | — | — | CN | disclosed |
| CN-101613321-A | The list and the bicyclic pyrrole derivatives that suppress part and advanced glycation end product acceptor interaction | TRANSTECH PHARMA INC | 2009-12-30 | — | — | CN | disclosed |
| CN-101597262-A | The list and the bicyclic pyrrole derivatives that suppress part and advanced glycation end product acceptor interaction | TRANSTECH PHARMA INC (US) | 2009-12-09 | — | — | CN | disclosed |
| CN-100525763-C | Mono-and bicyclic pyrrole derivatives inhibiting ligand interaction with higher glycation end product receptors | TRANSTECH PHARMA INC (US) | 2009-08-12 | — | — | CN | disclosed |
| CN-101142485-A | Use of antibody-surrogate antigen systems for detection of analytes | APPLERA CORP (US) | 2008-03-12 | — | — | CN | disclosed |
| CN-1633290-A | Mono-and bicyclic pyrrole derivatives inhibiting ligand interaction with higher glycation end product receptors | TRANSTECH PHARMA INC (US) | 2005-06-29 | — | — | CN | disclosed |
| US-6468977-B1 | COMPOUNDS USEFUL IN TREATMENT TREATMENT OF DISORDER AND/OR DISEASE CAUSED BY ACTIVITY OF ENZYMES SUCH AS HUMAN RHINOVIRUS 3C PROTEASE, TRANSGLUTAMINASE AND CATHEPSINS | APOTEX INC. (CA) | 2002-10-22 | — | — | US | disclosed |