⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12875846 | 0.81 | — | — | |
| SCHEMBL252802 | 0.80 | — | — | |
| SCHEMBL253904 | 0.77 | — | — | |
| SCHEMBL4289794 | 0.76 | TSHR (0.31) | — | |
| SCHEMBL435798 | 0.73 | — | — | |
| SCHEMBL253386 | 0.71 | — | — | |
| SCHEMBL17449214 | 0.69 | — | — | |
| SCHEMBL2748053 | 0.67 | — | — | |
| SCHEMBL9184075 | 0.67 | — | — | |
| SCHEMBL252979 | 0.66 | TSHR (0.33) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108017663-B | Method for producing silane compound containing bis (silyl) amino group | 信越化学工业株式会社 | 2022-05-13 | — | — | CN | disclosed |
| US-8921554-B2 | Substituted 1,2-azaborine heterocycles | STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF OREGON (US) | 2014-12-30 | — | — | US | disclosed |
| WO-2011017129-A1 | SUBSTITUTED 1,2-AZABORINE HETEROCYCLES | STATE OF OREGON ON BEHALF OF THE UNIVERSITY OF OREGON (US) | 2011-02-10 | — | — | WO | disclosed |
| WO-2011017131-A1 | AZABORINE COMPOUNDS AS HYDROGEN STORAGE SUBSTRATES | STATE OF OREGON (US) | 2011-02-10 | — | — | WO | disclosed |
| US-20110021735-A1 | SUBSTITUTED 1,2-AZABORINE HETEROCYCLES | STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF OREGON | 2011-01-27 | — | — | US | disclosed |
| US-20110021735-A1 | SUBSTITUTED 1,2-AZABORINE HETEROCYCLES | STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF OREGON | 2011-01-27 | — | — | US | disclosed |
| US-20110021818-A1 | AZABORINE COMPOUNDS AS HYDROGEN STORAGE SUBSTRATES | UNITED STATES DEPARTMENT OF ENERGY | 2011-01-27 | — | — | US | disclosed |
| US-6087520-A | Preparation of 1,3-bis(3-aminopropyl)tetramethyldisiloxane | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2000-07-11 | — | — | US | disclosed |