⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24508042 | 0.75 | APLNR (0.33) | — | |
| SCHEMBL15629712 | 0.71 | HSD11B1 (0.30) | — | |
| SCHEMBL18160268 | 0.71 | — | — | |
| SCHEMBL25069360 | 0.71 | — | — | |
| SCHEMBL17451650 | 0.71 | HSD11B1 (0.30) | — | |
| SCHEMBL13877832 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL13877831 | 0.69 | — | — | |
| SCHEMBL11955215 | 0.69 | RECQL (0.34) | — | |
| SCHEMBL16724493 | 0.67 | — | — | |
| SCHEMBL2623474 | 0.67 | — | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20060079699-A1 | Intermediate compounds and methods for synthesizing chemiluminescent dioxetane substrates | APPLIED BIOSYSTEMS, LLC | 2006-04-13 | — | — | US | disclosed |
| US-6417380-B1 | POLYCYCLOALKYL KETONE CONTAINING FLUORESCENT CHROMOPHORE IS ALKYLATED TO POLYCYCLOALKYLIDENE ETHER IN PRESENCE OF ALKALI METAL ALKOXIDE IN POLAR APROTIC SOLVENT | APPLIED BIOSYSTEMS, LLC | 2002-07-09 | — | — | US | disclosed |
| US-6124478-A | Methods of using 1,2-dioxetanes and kits therefore | TROPIX, INC. (US) | 2000-09-26 | — | — | US | disclosed |
| US-5856522-A | Method of using synthesis of 1,2-dioxetanes and kits therefore | TROPIX, INC. (US) | 1999-01-05 | — | — | US | disclosed |
| US-5777133-A | Synthesis of 1, 2-dioxetanes and intermediates therefor | TROPIX, INC. (US) | 1998-07-07 | — | — | US | disclosed |
| US-5679802-A | 1,2-dioxetanes useful in chemiluminescent immunoassays | TROPIX, INC. (US) | 1997-10-21 | — | — | US | disclosed |
| US-5648555-A | Alkenes | APPLIED BIOSYSTEMS, LLC | 1997-07-15 | — | — | US | disclosed |
| US-5637747-A | Synthesis of 1,2-dioxetanes and intermediates therefor | TROPIX, INC. (US) | 1997-06-10 | — | — | US | disclosed |
| US-5625077-A | 1,2-dioxetanes | TROPIX, INC. (US) | 1997-04-29 | — | — | US | disclosed |
| EP-0582317-A2 | Synthesis of 1,2-dioxetanes and intermediates therefor | TROPIX, INC. (US) | 1994-02-09 | — | — | EP | disclosed |
| US-5177241-A | SYNTHESIS OF 1,2-DIOXETANES AND INTERMEDIATES THEREFOR | APPLIED BIOSYSTEMS, LLC | 1993-01-05 | — | — | US | disclosed |
| US-4956477-A | Synthesis of 1,2-dioxetanes | TROPIX, INC. (US) | 1990-09-11 | — | — | US | disclosed |
| EP-0368946-A1 | 1,2-DIOXETANES. | QUEST SYSTEMS INC (US) | 1990-05-23 | — | — | EP | disclosed |
| EP-0368946-A4 | 1,2-DIOXETANES. | QUEST SYSTEMS INC (US) | 1990-05-14 | — | — | EP | disclosed |
| WO-1989006226-A1 | SYNTHESIS OF 1,2-DIOXETANES AND INTERMEDIATES THEREFOR | QUEST SYSTEMS, INC. (US) | 1989-07-13 | — | — | WO | disclosed |