⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21194956 | 0.81 | — | — | |
| SCHEMBL2541412 | 0.74 | CYP3A4 (0.35) | — | |
| SCHEMBL1370094 | 0.73 | NPSR1 (0.37) | — | |
| SCHEMBL7385758 | 0.71 | ALDH1A1 (0.31) | — | |
| SCHEMBL7893571 | 0.69 | — | — | |
| SCHEMBL5898027 | 0.69 | LDHA (0.42) | — | |
| SCHEMBL562764 | 0.67 | — | — | |
| SCHEMBL815174 | 0.67 | LMNA (0.37) | — | |
| SCHEMBL815175 | 0.67 | LMNA (0.37) | — | |
| SCHEMBL3903875 | 0.67 | LMNA (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011011277-A1 | INHIBITOR(S) OF TRANSPORTERS OR UPTAKE OF MONOAMINERGIC NEUROTRANSMITTERS | STATE OF OREGON ACTING BY & THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF OREGON STATE UNIVERSITY (US) | 2011-01-27 | — | — | WO | claimed |
| US-20110009617-A1 | Ruthenium Catalysts and Uses Thereof | CHE CHI-MING | 2011-01-13 | — | — | US | claimed |
| EP-3368521-A1 | CONDENSED BICYCLIC HETEROCYCLE DERIVATIVES AS PEST CONTROL AGENTS | Bayer CropScience Aktiengesellschaft (DE) | 2018-09-05 | — | — | EP | disclosed |
| WO-2017072039-A1 | CONDENSED BICYCLIC HETEROCYCLE DERIVATIVES AS PEST CONTROL AGENTS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2017-05-04 | — | — | WO | disclosed |
| US-8772330-B2 | Inhibitor(s) of transporters or uptake of monoaminergic neurotransmitters | STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF OREGON STATE UNIVERSITY (US) | 2014-07-08 | — | — | US | disclosed |
| US-8618023-B2 | Microbiocides | SYNGENTA CROP PROTECTION, LLC (US) | 2013-12-31 | — | — | US | disclosed |
| US-20120190725-A1 | INHIBITOR(S) OF TRANSPORTERS OR UPTAKE OF MONOAMINERGIC NEUROTRANSMITTERS | STATE UNIVERSITY | 2012-07-26 | — | — | US | disclosed |
| WO-2011011277-A1 | INHIBITOR(S) OF TRANSPORTERS OR UPTAKE OF MONOAMINERGIC NEUROTRANSMITTERS | STATE OF OREGON ACTING BY & THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF OREGON STATE UNIVERSITY (US) | 2011-01-27 | — | — | WO | disclosed |
| US-20110009617-A1 | Ruthenium Catalysts and Uses Thereof | CHE CHI-MING | 2011-01-13 | — | — | US | disclosed |
| US-20100022570-A1 | NOVEL MICROBIOCIDES | SYNGENTA CROP PROTECTION, INC. (US) | 2010-01-28 | — | — | US | disclosed |
| EP-2018367-B1 | NOVEL MICROBIOCIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2009-11-18 | — | — | EP | disclosed |
| EP-2018367-A1 | NOVEL MICROBIOCIDES | Syngeta Participations AG (CH) | 2009-01-28 | — | — | EP | disclosed |
| WO-2007134799-A1 | NOVEL MICROBIOCIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2007-11-29 | — | — | WO | disclosed |