⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2357309 | 1.00 | — | — | |
| SCHEMBL4303715 | 1.00 | — | — | |
| SCHEMBL16390024 | 0.97 | HTT (0.55) | — | |
| SCHEMBL10399683 | 0.97 | HTT (0.55) | — | |
| SCHEMBL382200 | 0.97 | HTT (0.55) | — | |
| Hydrochloric Acid SCHEMBL9485791 | 0.97 | HTT (0.50) | — | |
| SCHEMBL16390108 | 0.97 | HTT (0.55) | — | |
| SCHEMBL380548 | 0.97 | HTT (0.55) | — | |
| SCHEMBL16390157 | 0.97 | HTT (0.55) | — | |
| SCHEMBL11676992 | 0.97 | HTT (0.55) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009086283-A1 | SYNTHESIS OF ENANTIOMERICALLY PURE 2-HYDROXY-2-ARYL-ETHYLAMINES | CAMBREX CHARLES CITY, INC. (US) | 2009-07-09 | — | — | WO | claimed |
| JP-6100514-A | — | — | None | — | — | JP | disclosed |
| JP-8268992-A | — | — | None | — | — | JP | disclosed |
| JP-H08268992-A | OPTICALLY ACTIVE 2-ALKOXYCARBONYLAMINO-1-ARYLETHANOL COMPOUND AND ITS PRODUCTION | KAWAKEN FINE CHEM CO LTD | 1996-10-15 | — | — | JP | disclosed |
| JP-H06100514-A | OPTICALLY ACTIVE @(3754/24)S)-AND (R)-2-ACYLAMINO-1-ARYLETHANOL DERIVATIVE AND THEIR PRODUCTION | KAWAKEN FINE CHEM CO LTD | 1994-04-12 | — | — | JP | disclosed |