⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15127853 | 0.74 | — | — | |
| SCHEMBL22992417 | 0.68 | — | — | |
| SCHEMBL22992314 | 0.68 | — | — | |
| SCHEMBL24601692 | 0.68 | — | — | |
| SCHEMBL9173343 | 0.67 | — | — | |
| SCHEMBL12221394 | 0.67 | — | — | |
| SCHEMBL15667194 | 0.65 | — | — | |
| SCHEMBL20741108 | 0.64 | — | — | |
| SCHEMBL13465926 | 0.62 | — | — | |
| SCHEMBL7517397 | 0.61 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2097415-B1 | 8-ETHINYLXANTHINE DERIVATIVES AS SELECTIVE A2A RECEPTOR ANTAGONISTS | UNIV BONN (DE) | 2014-10-29 | — | — | EP | claimed |
| US-9219123-B2 | Method of producing a nitride semiconductor crystal with precursor containing carbon and oxygen, and nitride semiconductor crystal and semiconductor device made by the method | SHARP KABUSHIKI KAISHA (JP) | 2015-12-22 | — | — | US | disclosed |
| US-20140145202-A1 | NITRIDE SEMICONDUCTOR CRYSTAL | SHARP KABUSHIKI KAISHA (JP) | 2014-05-29 | — | — | US | disclosed |
| WO-2013033209-A1 | POLY (HYDROXY ALKANOATE) CO-POLYMERS | NOVOMER, INC. (US) | 2013-03-07 | — | — | WO | disclosed |
| US-7270699-B2 | Ink set for ink-jet recording, ink-jet recording method and ink-jet recording apparatus | FUJI XEROX CO., LTD. (JP) | 2007-09-18 | — | — | US | disclosed |
| US-20050166792-A1 | Ink set for ink-jet recording, ink-jet recording method and ink-jet recording apparatus | FUJI XEROX CO., LTD. (JP) | 2005-08-04 | — | — | US | disclosed |
| US-4520200-A | CHEMICAL INTERMEDIATES FOR BRONCHODILATOR AGENT | ZAMBON S.P.A. (IT) | 1985-05-28 | — | — | US | disclosed |
| EP-0016255-B1 | ISOXAZOLE DERIVATIVE, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | ZAMBON S.p.A. (IT) | 1983-09-28 | — | — | EP | disclosed |
| US-4276299-A | BRONCHODILATOR AGENTS | ZAMBON S.P.A. (IT) | 1981-06-30 | — | — | US | disclosed |
| EP-0016255-A2 | Isoxazole derivative, preparation thereof and pharmaceutical compositions containing the same | ZAMBON S.p.A. (IT) | 1980-10-01 | — | — | EP | disclosed |