⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1471141 | 0.76 | — | — | |
| SCHEMBL2443161 | 0.76 | — | — | |
| SCHEMBL31587885 | 0.69 | POLB (0.34) | — | |
| SCHEMBL13824104 | 0.67 | — | — | |
| SCHEMBL4327315 | 0.66 | DDB1 (0.41) | — | |
| SCHEMBL3971856 | 0.66 | ALOX5 (0.32) | — | |
| SCHEMBL3977600 | 0.66 | CA1 (0.32) | — | |
| SCHEMBL4503382 | 0.66 | TDP1 (0.35) | — | |
| SCHEMBL6288737 | 0.64 | — | — | |
| SCHEMBL1856117 | 0.62 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113906024-B | Condensed heterocyclic compound having nitrogen atom in crosslinking part, salt thereof, agricultural and horticultural insecticide containing the same, and method for using the same | 日本农药株式会社 | 2023-10-20 | — | — | CN | disclosed |
| CN-111741951-B | Amide compound or salt thereof, agricultural/horticultural fungicide containing the same, and method for using the same | 日本农药株式会社 | 2023-08-18 | — | — | CN | disclosed |
| US-9365612-B2 | Caspase inhibitors | UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2016-06-14 | — | — | US | disclosed |
| US-20120294843-A1 | CASPASE INHIBITORS | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES | 2012-11-22 | — | — | US | disclosed |
| WO-2011094426-A1 | CASPASE INHIBITORS | THE UNITED STATE OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH & HUMAN SERVICES (US) | 2011-08-04 | — | — | WO | disclosed |
| CN-100384727-C | Carrier based on granules produced from pyrogenically prepared silicon dioxides | DEGUSSA (DE) | 2008-04-30 | — | — | CN | disclosed |
| US-20060229210-A1 | Carrier based on granules produced from pyrogenically prepared silicon dioxides | EVONIK DEGUSSA GMBH (DE) | 2006-10-12 | — | — | US | disclosed |
| CN-1835890-A | Carrier based on granules produced from pyrogenically prepared silicon dioxides | DEGUSSA (DE) | 2006-09-20 | — | — | CN | disclosed |
| US-20060166856-A1 | Fragrance composition comprising at least one ionic liquid, method for production and use thereof | DEGUSSA AG (DE) | 2006-07-27 | — | — | US | disclosed |
| EP-1654197-A1 | CARRIER BASED ON GRANULES PRODUCED FROM PYROGENICALLY PREPARED SILICON DIOXIDES | Degussa AG (DE) | 2006-05-10 | — | — | EP | disclosed |
| EP-1549284-A2 | FRAGRANCE COMPOSITION COMPRISING AT LEAST ONE IONIC FLUID, METHOD FOR PRODUCTION AND USE THEREOF | Degussa AG (DE) | 2005-07-06 | — | — | EP | disclosed |
| WO-2005016823-A1 | CARRIER BASED ON GRANULES PRODUCED FROM PYROGENICALLY PREPARED SILICON DIOXIDES | DEGUSSA AG (DE) | 2005-02-24 | — | — | WO | disclosed |
| WO-2004035018-A2 | FRAGRANCE COMPOSITION COMPRISING AT LEAST ONE IONIC FLUID, METHOD FOR PRODUCTION AND USE THEREOF | DEGUSSA AG (DE) | 2004-04-29 | — | — | WO | disclosed |
| US-6235899-B1 | SYNTHESIS OF COMPOUNDS WHICH INHIBIT INTERLEUKIN-1BETA CONVERTING ENZYME. | HOECHST MARION ROUSSEL (FR) | 2001-05-22 | — | — | US | disclosed |