Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Tert-Butylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| Tert-Butylamine SCHEMBL1191200 | 0.84 | — | — | |
| Hexane SCHEMBL6284358 | 0.82 | TSHR (0.54) | — | |
| Butane SCHEMBL3412875 | 0.82 | TSHR (0.43) | — | |
| Tert-Butylamine SCHEMBL8950116 | 0.82 | — | — | |
| Tert-Butylamine SCHEMBL10839353 | 0.80 | — | — | |
| Butane SCHEMBL11348531 | 0.78 | — | — | |
| Butane SCHEMBL10663155 | 0.78 | — | — | |
| Tert-Butylamine SCHEMBL5736553 | 0.78 | — | — | |
| Tert-Butylamine SCHEMBL8051 | 0.78 | — | — | |
| Tert-Butylamine SCHEMBL6064515 | 0.78 | FDPS (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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106463771-A | Gelated ionic liquid film coated surfaces and uses thereof | 格利恩技术私人有限公司 | 2017-02-22 | — | — | CN | claimed |
| EP-2265617-B1 | SOLVENTS | BIONIQS LTD (GB) | 2014-07-02 | — | — | EP | disclosed |
| EP-2265617-A1 | SOLVENTS | Bioniqs Limited (GB) | 2010-12-29 | — | — | EP | disclosed |
| WO-2009034329-A1 | SOLVENTS | BIONIQS LIMITED (GB) | 2009-03-19 | — | — | WO | disclosed |