Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.49 |
| ▸ | IDO1 | P14902 | 3/20 | 0.43 |
| ▸ | PNMT | P11086 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR1E | P28566 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL11667015 | 0.85 | ALDH1A1 (0.56) | ALDH1A1LMNAHTTPYCR1BCHE | |
| SCHEMBL31438230 | 0.83 | IDO1 (0.54) | ALDH1A1LMNAPYCR1IDO1PNMT | |
| SCHEMBL10882173 | 0.77 | TAAR1 (0.47) | TAAR1AOC3BCHEHTR1AADRA2A | |
| SCHEMBL10974173 | 0.76 | ALDH1A1 (0.49) | ALDH1A1LMNAHTTPYCR1BCHE | |
| SCHEMBL11526249 | 0.76 | MAPT (0.50) | ALDH1A1LMNAHTTPYCR1TAAR1 | |
| SCHEMBL4942839 | 0.76 | ALDH1A1 (0.53) | ALDH1A1LMNAHTTIDO1TAAR1 | |
| SCHEMBL5611653 | 0.76 | ALDH1A1 (0.49) | ALDH1A1LMNAHTTPYCR1PNMT | |
| SCHEMBL1110914 | 0.76 | ALDH1A1 (0.49) | ALDH1A1LMNAHTTPYCR1BCHE | |
| SCHEMBL16715934 | 0.75 | BCHE (0.54) | ALDH1A1LMNAHTTPYCR1IDO1 | |
| SCHEMBL248417 | 0.74 | IDO1 (0.50) | ALDH1A1LMNAHTTIDO1PNMT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170057907-A1 | METHOD FOR THE REDUCTIVE AMINATION OF ALDEHYDES | BASF SE (DE) | 2017-03-02 | — | — | US | disclosed |
| US-9040751-B2 | Method for producing ring-halogenated N,N-dialkylbenzylamines | LANXESS DEUTSCHLAND GMBH (US) | 2015-05-26 | — | — | US | disclosed |
| US-20140221691-A1 | METHOD FOR PRODUCING RING-HALOGENATED N,N-DIALKYLBENZYLAMINES | LANXESS DEUTSCHLAND GMBH (DE) | 2014-08-07 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20140221691-A1 | METHOD FOR PRODUCING RING-HALOGENATED N,N-DIALKYLBENZYLAMINES | NPM1, UGT1A6, NNMT | ALDH1A1 1159/4885LMNA 2147/4885HTT 210/4885 |
| US-20170057907-A1 | METHOD FOR THE REDUCTIVE AMINATION OF ALDEHYDES | AOX1, ADH5, AOC2 | ALDH1A1 26/4885LMNA 2284/4885HTT 1750/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.