⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1976705 | 0.87 | — | — | |
| SCHEMBL55485 | 0.83 | — | — | |
| SCHEMBL11674541 | 0.82 | TSHR (0.32) | — | |
| SCHEMBL11677323 | 0.80 | TSHR (0.35) | — | |
| SCHEMBL8551965 | 0.78 | — | — | |
| SCHEMBL4574956 | 0.78 | — | — | |
| Hydrazine SCHEMBL28206236 | 0.76 | CYP2D6 (0.35) | — | |
| SCHEMBL27495721 | 0.75 | LMNA (0.34) | — | |
| SCHEMBL6274695 | 0.73 | — | — | |
| SCHEMBL27429387 | 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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107001057-B | Use the zeolite of organic -1- oxa- -4- azo-cycle hexane compound | 环球油品公司 | 2019-11-05 | — | — | CN | claimed |
| CN-107001057-A | Use the zeolite of organic azo-cycle hexane compound of 1 oxa- 4 | 环球油品公司 | 2017-08-01 | — | — | CN | claimed |
| CN-107001058-B | Use the aluminophosphate molecular sieve of organic group -1- oxa- -4- azo-cycle hexane compound | 环球油品公司 | 2019-11-05 | — | — | CN | disclosed |
| CN-107001057-B | Use the zeolite of organic -1- oxa- -4- azo-cycle hexane compound | 环球油品公司 | 2019-11-05 | — | — | CN | disclosed |
| CN-107001057-A | Use the zeolite of organic azo-cycle hexane compound of 1 oxa- 4 | 环球油品公司 | 2017-08-01 | — | — | CN | disclosed |
| CN-107001058-A | Use the aluminophosphate molecular sieve of the azo-cycle hexane compound of 1 oxa- of organic group 4 | 环球油品公司 | 2017-08-01 | — | — | CN | disclosed |
| EP-2521707-B1 | BISPHENOL DERIVATIVES AND THEIR USE AS ANDROGEN RECEPTOR ACTIVITY MODULATORS | BRITISH COLUMBIA CANCER AGENCY BRANCH (CA) | 2017-06-14 | — | — | EP | disclosed |
| US-4046819-A | Alkylation of alkyl, cycloalkyl and aralkyl halides | UOP INC. (US) | 1977-09-06 | — | — | US | disclosed |