Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14242300 | 0.95 | CYP2A6 (0.53) | CYP2A6TDP1CYP1A2SIGMAR1MAOA | |
| SCHEMBL13367566 | 0.92 | CYP2A6 (0.46) | CYP2A6TDP1CYP1A2SIGMAR1MAOA | |
| SCHEMBL5504032 | 0.92 | CYP2A6 (0.43) | CYP2A6TDP1CYP1A2SIGMAR1MAOA | |
| SCHEMBL13829463 | 0.91 | CYP2A6 (0.49) | CYP2A6TDP1CYP1A2SIGMAR1MAOA | |
| SCHEMBL18134987 | 0.91 | HTT (0.44) | CYP2A6TDP1CYP1A2SIGMAR1MAOA | |
| SCHEMBL17702092 | 0.90 | CYP2A6 (0.44) | CYP2A6TDP1CYP1A2SIGMAR1MAOA | |
| SCHEMBL29527479 | 0.90 | SIGMAR1 (0.44) | CYP2A6TDP1CYP1A2SIGMAR1ALDH1A1 | |
| SCHEMBL78401 | 0.90 | SIGMAR1 (0.44) | CYP2A6TDP1CYP1A2SIGMAR1ALDH1A1 | |
| SCHEMBL5051402 | 0.89 | L3MBTL1 (0.43) | CYP2A6TDP1CYP1A2SIGMAR1MAOA | |
| SCHEMBL18134984 | 0.89 | HTT (0.46) | CYP2A6TDP1CYP1A2SIGMAR1MAOA |
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 |
|---|---|---|---|---|---|---|---|
| US-20100108997-A1 | Novel organic electroluminescent compounds and organic electroluminescent device using the same | GRACEL DISPLAY INC. (KR) | 2010-05-06 | — | — | 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 (1 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-20100108997-A1 | Novel organic electroluminescent compounds and organic electroluminescent device using the same | OR10J3, OCIAD1, OCIAD2 | CYP2A6 2286/4885TDP1 3318/4885CYP1A2 1021/4885 |
“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.