Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | AR | P10275 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | GFER | P55789 | 1/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.51 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.51 |
| ▸ | NOS1 | P29475 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30414157 | 0.85 | CYP1A2 (0.55) | CYP1A2ALDH1A1SMN1; SMN2KDM4ENPC1 | |
| SCHEMBL16542814 | 0.85 | CYP1A2 (0.55) | CYP1A2ALDH1A1SMN1; SMN2KDM4ENPC1 | |
| SCHEMBL31517113 | 0.84 | PARP1 (0.58) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL10032275 | 0.84 | CYP1A1 (0.51) | CYP1A2ALDH1A1SMN1; SMN2KDM4ENPC1 | |
| SCHEMBL1033940 | 0.84 | PARP1 (0.58) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL10032247 | 0.83 | CYP1A1 (0.55) | CYP1A2ALDH1A1SMN1; SMN2KDM4ENPC1 | |
| SCHEMBL10032271 | 0.83 | CYP1A2 (0.53) | CYP1A2ALDH1A1SMN1; SMN2KDM4ENPC1 | |
| SCHEMBL10032315 | 0.82 | CYP11B1 (0.53) | CYP1A2ALDH1A1SMN1; SMN2KDM4ENPC1 | |
| SCHEMBL10032272 | 0.82 | CYP1A1 (0.53) | CYP1A2ALDH1A1SMN1; SMN2KDM4ENPC1 | |
| SCHEMBL10032401 | 0.82 | CYP1A2 (0.52) | CYP1A2ALDH1A1SMN1; SMN2KDM4ENPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8597798-B2 | Materials for organic electroluminescent devices | MERCK PATENT GMBH (DE) | 2013-12-03 | — | — | US | disclosed |
| US-20110095281-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2011-04-28 | — | — | 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 (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-20110095281-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | SOD1, EPCAM, ICMT | CYP1A2 364/4885ALDH1A1 283/4885SMN1; SMN2 3589/4885 |
“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.