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 SCHEMBL10505163 | 0.96 | — | — | |
| Acetonitrile SCHEMBL29100059 | 0.80 | — | — | |
| Tert-Butylamine SCHEMBL331675 | 0.80 | — | — | |
| Tert-Butylamine SCHEMBL7781705 | 0.80 | — | — | |
| Tert-Butylamine SCHEMBL11613122 | 0.78 | — | — | |
| Acetonitrile SCHEMBL28242746 | 0.75 | — | — | |
| Acetonitrile SCHEMBL28029152 | 0.75 | — | — | |
| Acetonitrile SCHEMBL21243812 | 0.75 | — | — | |
| Acetonitrile SCHEMBL1295727 | 0.75 | — | — | |
| Tert-Butylamine SCHEMBL6330044 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106165140-B | Organic light emitting device | 剑桥显示技术有限公司 | 2018-11-30 | — | — | CN | disclosed |