⚠ 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 | |
|---|---|---|---|---|
| Oxypurinol SCHEMBL2077651 | 0.79 | — | — | |
| SCHEMBL95393 | 0.76 | — | — | |
| SCHEMBL1952035 | 0.76 | — | — | |
| Tisopurine SCHEMBL7160585 | 0.67 | — | — | |
| SCHEMBL7635298 | 0.64 | XDH (0.34) | — | |
| SCHEMBL8128088 | 0.63 | — | — | |
| SCHEMBL15397499 | 0.60 | MAPK1 (0.32) | — | |
| SCHEMBL833645 | 0.60 | GDA (0.41) | — | |
| Allopurinol SCHEMBL167561 | 0.58 | CCNE2 (0.31) | — | |
| SCHEMBL1128499 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0881875-A4 | COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS | VIRGINIA TECH INTELL PROP (US) | 2002-03-06 | — | — | EP | claimed |
| US-6037344-A | COMPRISING A PURINE SELECTED FROM THE GROUP CONSISTING OF XANTHINE, HYPOXANTHINE, GUANINE AND MIXTURES THEREOF, AND A XANTHINE OXIDASE INHIBITOR SELECTED FROM THE GROUP CONSISTING OF ALLOPURINOL, OXYPURINOL, MERCAPTO-ALLOPURINOL, | VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) | 2000-03-14 | — | — | US | claimed |
| EP-0881875-A1 | COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS | VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) | 1998-12-09 | — | — | EP | claimed |
| WO-1997028686-A1 | COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS | VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) | 1997-08-14 | — | — | WO | claimed |
| EP-0881875-A4 | COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS | VIRGINIA TECH INTELL PROP (US) | 2002-03-06 | — | — | EP | disclosed |
| US-6037344-A | COMPRISING A PURINE SELECTED FROM THE GROUP CONSISTING OF XANTHINE, HYPOXANTHINE, GUANINE AND MIXTURES THEREOF, AND A XANTHINE OXIDASE INHIBITOR SELECTED FROM THE GROUP CONSISTING OF ALLOPURINOL, OXYPURINOL, MERCAPTO-ALLOPURINOL, | VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) | 2000-03-14 | — | — | US | disclosed |
| US-5990115-A | Compositions and methods for controlling pest insects | VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) | 1999-11-23 | — | — | US | disclosed |
| EP-0777417-A4 | COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS | VIRGINIA TECH INTELL PROP (US) | 1999-03-17 | — | — | EP | disclosed |
| EP-0881875-A1 | COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS | VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) | 1998-12-09 | — | — | EP | disclosed |
| WO-1997028686-A1 | COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS | VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) | 1997-08-14 | — | — | WO | disclosed |
| EP-0777417-A1 | COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS | VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) | 1997-06-11 | — | — | EP | disclosed |
| US-5620982-A | MIXTURE OF A PURINE, OXYPURINOL, AND TRIMETHOPRIM; METABOLIC DISRUPTION, ANTIGROWTH AGENTS | VIRGINIA TECH INTELLECTUAL PROPERTIES (US) | 1997-04-15 | — | — | US | disclosed |
| WO-1996004791-A1 | COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS | VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) | 1996-02-22 | — | — | WO | disclosed |