Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MGMT | P16455 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 10/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 9/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 9/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 8/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 7/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 6/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 5/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2098271 | 0.92 | HDAC1 (0.36) | CA2HTTHDAC1HDAC10HDAC6 | |
| SCHEMBL2098275 | 0.92 | HDAC1 (0.36) | CA2HTTHDAC1HDAC10HDAC6 | |
| SCHEMBL2101048 | 0.92 | PIN1 (0.44) | CA2KDM4EALDH1A1HTTHDAC1 | |
| SCHEMBL2101045 | 0.92 | PIN1 (0.44) | CA2KDM4EALDH1A1HTTHDAC1 | |
| SCHEMBL2054846 | 0.83 | HDAC1 (0.43) | CA2KDM4EALDH1A1HTTMGMT | |
| SCHEMBL2054840 | 0.80 | MGMT (0.41) | ALDH1A1MGMTHDAC1HDAC8HDAC2 | |
| SCHEMBL2101050 | 0.78 | PIN1 (0.43) | CA2HDAC1HDAC4PIN1 | |
| SCHEMBL2098277 | 0.77 | NPC1 (0.31) | KDM4EALDH1A1MAPT | |
| SCHEMBL2098052 | 0.75 | PIN1 (0.42) | CA2KDM4EALDH1A1HTTHDAC1 | |
| SCHEMBL2098051 | 0.75 | PIN1 (0.42) | CA2KDM4EALDH1A1HTTHDAC1 |
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-8163479-B2 | Specific substrates for O6-alkylguanine-DNA alkyltransferase | ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) | 2012-04-24 | — | — | US | disclosed |
| US-8163479-B2 | Specific substrates for O6-alkylguanine-DNA alkyltransferase | ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) | 2012-04-24 | — | — | US | disclosed |
| US-20070243568-A1 | Specific Substrates for O6-Alkylguanine-Dna Alkyltransferase | EPFL ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) | 2007-10-18 | — | — | US | disclosed |
| US-20070243568-A1 | Specific Substrates for O6-Alkylguanine-Dna Alkyltransferase | EPFL ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) | 2007-10-18 | — | — | 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-20070243568-A1 | Specific Substrates for O6-Alkylguanine-Dna Alkyltransferase | AGT, AGXT, AGTR1 | CA2 3221/4885KDM4E 3573/4885ALDH1A1 893/4885 |
“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.