Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NQO2 | P16083 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8204171 | 0.85 | RELA (0.53) | RELACYP1A2ALDH1A1KDM4EL3MBTL1 | |
| SCHEMBL8668276 | 0.82 | CYP2D6 (0.48) | RELACYP1A2CYP1A1CYP1B1CYP3A4 | |
| SCHEMBL8668861 | 0.82 | RAB9A (0.51) | RELACYP1A2ALDH1A1KDM4EL3MBTL1 | |
| SCHEMBL5966235 | 0.77 | CYP1A2 (0.46) | CYP1A2ALDH1A1CYP3A4CYP2D6CYP19A1 | |
| SCHEMBL8202649 | 0.75 | CYP3A4 (0.48) | CYP1A2ALDH1A1KDM4ERAB9ACYP3A4 | |
| SCHEMBL8670948 | 0.75 | SMN1; SMN2 (0.46) | RELAALDH1A1KDM4EL3MBTL1RAB9A | |
| SCHEMBL5812504 | 0.75 | RELA (0.42) | RELACYP1A2ALDH1A1KDM4EL3MBTL1 | |
| SCHEMBL4800219 | 0.74 | CYP1A1 (0.49) | RELACYP1A2CYP1A1CYP1B1ALDH1A1 | |
| SCHEMBL2604933 | 0.74 | RELA (0.70) | RELACYP1A2CYP1A1CYP1B1ALDH1A1 | |
| SCHEMBL3163586 | 0.74 | RELA (0.70) | RELACYP1A2CYP1A1CYP1B1ALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2825157-B1 | AMINOACID LIPIDS | MERCK PATENT GMBH (DE) | 2018-09-05 | — | — | EP | disclosed |
| US-9796666-B2 | Aminoacid lipids | MERCK PATENT GMBH (DE) | 2017-10-24 | — | — | US | disclosed |
| US-20150030670-A1 | AMINOACID LIPIDS | MERCK PATENT GMBH (DE) | 2015-01-29 | — | — | US | disclosed |
| EP-2825157-A1 | AMINOACID LIPIDS | Merck Patent GmbH (DE) | 2015-01-21 | — | — | EP | disclosed |
| WO-2013135360-A1 | AMINOACID LIPIDS | MERCK PATENT GMBH (DE) | 2013-09-19 | — | — | WO | disclosed |
| US-5811422-A | USEFUL FOR TREATING VIRAL INFECTIONS | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-09-22 | — | — | US | disclosed |
| US-5610294-A | VIRAL TREATMENT | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-03-11 | — | — | 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-20150030670-A1 | AMINOACID LIPIDS | PHOSPHO1, SLC7A5, SLC1A5 | RELA 4786/4885CYP1A2 2558/4885CYP1A1 3466/4885 |
“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.