Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | APAF1 | O14727 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | GALK1 | P51570 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22947628 | 0.88 | PDK2 (0.36) | CYP1A2PDK2SMN1; SMN2MEN1NPC1 | |
| SCHEMBL22941730 | 0.86 | S100A4 (0.40) | PDK2MAP4K4SMN1; SMN2NPC1RAB9A | |
| SCHEMBL22947475 | 0.86 | CYP1A2 (0.37) | CYP1A2PDK2MAP4K4HTTSMN1; SMN2 | |
| SCHEMBL22947588 | 0.84 | CYP1A2 (0.41) | CYP1A2PDK2MAP4K4HTTSMN1; SMN2 | |
| SCHEMBL22947689 | 0.84 | CYP2A6 (0.46) | PDK2AHR | |
| SCHEMBL22947624 | 0.84 | CYP2A6 (0.40) | CYP1A2PDK2MAP4K4HTTMEN1 | |
| SCHEMBL22947646 | 0.81 | MEN1 (0.40) | HTTSMN1; SMN2MEN1APAF1NPC1 | |
| SCHEMBL21310622 | 0.81 | MAPT (0.40) | CYP1A2PDK2HTTSMN1; SMN2MEN1 | |
| SCHEMBL22947695 | 0.81 | MEN1 (0.40) | HTTSMN1; SMN2MEN1APAF1NPC1 | |
| SCHEMBL22947542 | 0.78 | CYP1A2 (0.43) | CYP1A2PDK2MAP4K4HTTSMN1; SMN2 |
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-20210036245-A1 | HETEROAROMATIC COMPOUNDS | MERCK PATENT GMBH (DE) | 2021-02-04 | — | — | 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-20210036245-A1 | HETEROAROMATIC COMPOUNDS | ETV6, FES, LEF1 | CYP1A2 281/4885PDK2 1353/4885MAP4K4 3573/4885 |
“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.