⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21474261 | 1.00 | — | — | |
| SCHEMBL26189310 | 1.00 | — | — | |
| SCHEMBL6128498 | 1.00 | — | — | |
| SCHEMBL26189326 | 1.00 | — | — | |
| SCHEMBL21473192 | 1.00 | — | — | |
| SCHEMBL10001725 | 1.00 | — | — | |
| SCHEMBL11710032 | 0.84 | — | — | |
| SCHEMBL25312774 | 0.75 | — | — | |
| SCHEMBL11707268 | 0.75 | — | — | |
| SCHEMBL25874662 | 0.75 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9981992-B2 | Compositions and methods for reduction of ketones, aldehydes and iminiums, and products produced thereby | THE BOARD OF TRUSTEES OF NORTHERN ILLINOIS UNIVERSITY (US) | 2018-05-29 | — | — | US | disclosed |
| US-9981992-B2 | Compositions and methods for reduction of ketones, aldehydes and iminiums, and products produced thereby | THE BOARD OF TRUSTEES OF NORTHERN ILLINOIS UNIVERSITY (US) | 2018-05-29 | — | — | US | disclosed |
| US-20170362151-A1 | COMPOSITIONS AND METHODS FOR REDUCTION OF KETONES, ALDEHYDES AND IMINIUMS, AND PRODUCTS PRODUCED THEREBY | BOARD OF TRUSTEES OF NORTHERN ILLINOIS UNIVERSITY (US) | 2017-12-21 | — | — | US | disclosed |
| US-20170362151-A1 | COMPOSITIONS AND METHODS FOR REDUCTION OF KETONES, ALDEHYDES AND IMINIUMS, AND PRODUCTS PRODUCED THEREBY | BOARD OF TRUSTEES OF NORTHERN ILLINOIS UNIVERSITY (US) | 2017-12-21 | — | — | US | disclosed |