⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9560050 | 1.00 | — | — | |
| SCHEMBL15973132 | 1.00 | — | — | |
| Hydroxyamine SCHEMBL28312327 | 0.91 | ALDH1A1 (0.58) | — | |
| SCHEMBL1268269 | 0.82 | ALDH1A1 (1.00) | — | |
| SCHEMBL2059039 | 0.81 | — | — | |
| SCHEMBL10880550 | 0.76 | ALDH1A1 (0.73) | — | |
| SCHEMBL26250428 | 0.76 | ALDH1A1 (0.73) | — | |
| SCHEMBL264820 | 0.73 | — | — | |
| SCHEMBL15786308 | 0.73 | — | — | |
| SCHEMBL8049341 | 0.73 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017172979-A1 | SUBSTITUTED QUINAZOLINE COMPOUNDS AND METHODS OF USE | ARAXES PHARMA LLC (US) | 2017-10-05 | — | — | WO | disclosed |
| US-20170247376-A1 | METHODS AND COMPOSITIONS FOR INHIBITION OF RAS | ARAXES PHARMA LLC (US) | 2017-08-31 | — | — | US | disclosed |
| US-9573965-B2 | Process for the preparation of Dolutegravir | AUROBINDO PHARMA LTD (IN) | 2017-02-21 | — | — | US | disclosed |
| US-9573965-B2 | Process for the preparation of Dolutegravir | AUROBINDO PHARMA LTD (IN) | 2017-02-21 | — | — | US | disclosed |
| US-20160108058-A1 | An improved process for the preparation of Dolutegravir | AUROBINDO PHARMA LTD. (IN) | 2016-04-21 | — | — | US | disclosed |
| US-20160108058-A1 | An improved process for the preparation of Dolutegravir | AUROBINDO PHARMA LTD. (IN) | 2016-04-21 | — | — | US | disclosed |
| WO-2016049568-A1 | METHODS AND COMPOSITIONS FOR INHIBITION OF RAS | ARAXES PHARMA LLC (US) | 2016-03-31 | — | — | WO | disclosed |
| WO-2016049565-A1 | COMPOSITIONS AND METHODS FOR INHIBITION OF RAS | ARAXES PHARMA LLC (US) | 2016-03-31 | — | — | WO | disclosed |
| EP-0194554-B1 | PROCESS FOR PRODUCTION OF OXIME DERIVATIVES | NIPPON ZEON CO., LTD. (JP) | 1993-09-01 | — | — | EP | disclosed |
| US-4906768-A | Process for production of oxime derivatives | NIPPON ZEON CO., LTD. (JP) | 1990-03-06 | — | — | US | disclosed |
| EP-0194554-A2 | Process for production of oxime derivatives | NIPPON ZEON CO., LTD. (JP) | 1986-09-17 | — | — | EP | disclosed |