Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 11/20 | 1.00 |
| ▸ | MEN1 | O00255 | 2/20 | 0.76 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.76 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.67 |
| ▸ | CA12 | O43570 | 1/20 | 0.67 |
| ▸ | CA1 | P00915 | 1/20 | 0.67 |
| ▸ | CA2 | P00918 | 1/20 | 0.67 |
| ▸ | CA9 | Q16790 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 3/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.66 |
| ▸ | CNR1 | P21554 | 2/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL13253442 | 0.89 | CYP3A4 (0.80) | CYP3A4MEN1KMT2ACYP2C9CA12 | |
| SCHEMBL14970875 | 0.87 | CYP3A4 (1.00) | CYP3A4MEN1KMT2ACYP2C9CA12 | |
| SCHEMBL17689194 | 0.83 | CYP3A4 (0.77) | CYP3A4MEN1KMT2ACYP2C9CA12 | |
| SCHEMBL28459418 | 0.82 | DHODH (0.74) | CYP3A4KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL14970865 | 0.81 | CYP3A4 (0.81) | CYP3A4MEN1KMT2ACYP2C9CA12 | |
| SCHEMBL16783170 | 0.81 | KDM4E (0.77) | CYP3A4MEN1KMT2ACYP2C9CA12 | |
| SCHEMBL17681381 | 0.81 | MAPT (0.79) | CYP3A4MEN1KMT2ACYP2C9CA12 | |
| SCHEMBL14970890 | 0.81 | CYP3A4 (0.78) | CYP3A4MEN1KMT2AMAPTKDM4E | |
| SCHEMBL17689196 | 0.80 | CYP3A4 (0.77) | CYP3A4MEN1KMT2ACYP2C9MAPT | |
| SCHEMBL17689211 | 0.79 | KDM4E (1.00) | CYP3A4MEN1KMT2ACYP2C9CA12 |
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-20210244721-A1 | SMALL MOLECULE ENTEROVIRUS INHIBITORS AND USES THEREOF | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2021-08-12 | — | — | 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-20210244721-A1 | SMALL MOLECULE ENTEROVIRUS INHIBITORS AND USES THEREOF | AR, KLK3, BRDT | CYP3A4 856/4885MEN1 56/4885KMT2A 917/4885 |
“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.