Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 4/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.31 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.31 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.31 |
| ▸ | PLAU | P00749 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | GLB1 | P16278 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3757571 | 0.76 | CYP2A6 (0.57) | CYP2A6ALDH1A1ALOX15MAPK1TDP1 | |
| SCHEMBL18508 | 0.73 | — | — | |
| SCHEMBL11916255 | 0.71 | CYP2A6 (0.50) | CYP2A6ALDH1A1ALOX15MAPK1TDP1 | |
| SCHEMBL2884210 | 0.71 | CYP2A6 (0.50) | CYP2A6ALDH1A1ALOX15MAPK1TDP1 | |
| SCHEMBL11770595 | 0.71 | CYP2A6 (0.50) | CYP2A6ALDH1A1ALOX15MAPK1TDP1 | |
| SCHEMBL9717534 | 0.71 | CYP2A6 (0.50) | CYP2A6ALDH1A1ALOX15MAPK1TDP1 | |
| SCHEMBL972975 | 0.69 | — | — | |
| SCHEMBL7613201 | 0.69 | CYP2A6 (0.47) | CYP2A6ALDH1A1ALOX15MAPK1TDP1 | |
| SCHEMBL3138002 | 0.69 | — | — | |
| Methane SCHEMBL21489530 | 0.69 | CYP2A6 (0.89) | CYP2A6ALDH1A1ALOX15MAPK1TDP1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9871213-B2 | Organic electroluminescent device | MERCK PATENT GMBH (DE) | 2018-01-16 | — | — | US | disclosed |
| US-20160322570-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | MERCK PATENT GMBH (DE) | 2016-11-03 | — | — | US | disclosed |
| US-9403849-B2 | Organic electroluminescent device and boric acid and borinic acid derivatives used therein | MERCK PATENT GMBH (DE) | 2016-08-02 | — | — | US | disclosed |
| US-20150322091-A1 | ORGANIC ELECTROLUMINESCENT DEVICE AND BORIC ACID AND BORINIC ACID DERIVATIVES USED THEREIN | MERCK PATENT GMBH (DE) | 2015-11-12 | — | — | US | disclosed |
| US-8674141-B2 | Organic electroluminescent device and boric acid and borinic acid derivatives used therein | MERCK PATENT GMBH (DE) | 2014-03-18 | — | — | US | disclosed |
| US-20090134384-A1 | ORGANIC ELECTROLUMINESCENT DEVICE AND BORIC ACID AND BORINIC ACID DERIVATIVES USED THEREIN | MERCK PATENT GMBH (DE) | 2009-05-28 | — | — | 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 (3 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-20090134384-A1 | ORGANIC ELECTROLUMINESCENT DEVICE AND BORIC ACID AND BORINIC ACID DERIVATIVES USED THEREIN | BTD, ERG, OR10J3 | CYP2A6 2674/4885ALDH1A1 857/4885ALOX15 1041/4885 |
| US-20160322570-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | OR10J3, BTD, ERG | CYP2A6 3477/4885ALDH1A1 1034/4885ALOX15 1567/4885 |
| US-20150322091-A1 | ORGANIC ELECTROLUMINESCENT DEVICE AND BORIC ACID AND BORINIC ACID DERIVATIVES USED THEREIN | BTD, ERG, OR10J3 | CYP2A6 2674/4885ALDH1A1 857/4885ALOX15 1041/4885 |
“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.