Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 7/20 | 0.34 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.32 |
| ▸ | SCD | O00767 | 1/20 | 0.31 |
| ▸ | MYC | P01106 | 2/20 | 0.31 |
| ▸ | WDR5 | P61964 | 2/20 | 0.31 |
| ▸ | MMP10 | P09238 | 2/20 | 0.31 |
| ▸ | MMP8 | P22894 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL10143689 | 0.92 | CYP2C9 (0.44) | CYP2C9KCNH2MMP13KCNE1CCR1 | |
| SCHEMBL417695 | 0.91 | CYP2C9 (0.52) | CYP2C9KCNH2KCNE1CCR1KCNQ1 | |
| SCHEMBL10143829 | 0.85 | CYP2C9 (0.51) | CYP2C9KCNH2KCNE1CCR1KCNQ1 | |
| SCHEMBL51612 | 0.83 | CYP2C9 (0.47) | CYP2C9KCNH2MMP13KCNE1CCR1 | |
| SCHEMBL10143669 | 0.83 | CYP2C9 (0.54) | CYP2C9KCNH2KCNE1CCR1KCNQ1 | |
| SCHEMBL62514 | 0.80 | CYP2C9 (0.56) | CYP2C9KCNH2KCNE1CCR1KCNQ1 | |
| SCHEMBL422140 | 0.79 | KCNH2 (0.50) | CYP2C9KCNH2KCNE1CCR1KCNQ1 | |
| SCHEMBL52672 | 0.77 | CYP2C9 (0.48) | CYP2C9KCNH2MMP13KCNE1CCR1 | |
| SCHEMBL51956 | 0.77 | KCNH2 (0.45) | CYP2C9KCNH2KCNE1CCR1KCNQ1 | |
| SCHEMBL52059 | 0.77 | CYP2C9 (0.45) | CYP2C9KCNH2MMP13KCNE1CCR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120022045-A1 | BRIDGED COMPOUNDS AS HIV INTEGRASE INHIBITORS | VENKATRAMAN SHANKAR (US) | 2012-01-26 | — | — | US | claimed |
| US-20120022045-A1 | BRIDGED COMPOUNDS AS HIV INTEGRASE INHIBITORS | VENKATRAMAN SHANKAR (US) | 2012-01-26 | — | — | US | disclosed |
| US-20120022045-A1 | BRIDGED COMPOUNDS AS HIV INTEGRASE INHIBITORS | VENKATRAMAN SHANKAR (US) | 2012-01-26 | — | — | US | disclosed |
| WO-2010088167-A1 | BRIDGED COMPOUNDS AS HIV INTEGRASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2010-08-05 | — | — | WO | 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-20120022045-A1 | BRIDGED COMPOUNDS AS HIV INTEGRASE INHIBITORS | CCND3, CDK3, CDK2 | CYP2C9 1960/4885KCNH2 2502/4885MMP13 4141/4885 |
“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.