Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 4/20 | 0.49 |
| ▸ | PRSS12 | P56730 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | ESRRG | P62508 | 3/20 | 0.48 |
| ▸ | ESR1 | P03372 | 2/20 | 0.48 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | FABP3 | P05413 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12900103 | 0.94 | FABP3 (0.53) | HDAC6NPSR1TP53PRSS12MAPT | |
| SCHEMBL12900105 | 0.89 | FABP3 (0.55) | NPSR1TP53PRSS12SMN1; SMN2ESRRG | |
| SCHEMBL18573537 | 0.85 | NPC1 (0.63) | HDAC6TP53MAPTALDH1A1MEN1 | |
| SCHEMBL12900109 | 0.83 | ALDH1A1 (0.49) | TP53MAPTALDH1A1MEN1KMT2A | |
| SCHEMBL12900093 | 0.82 | NPC1 (0.49) | NPSR1TP53MAPTALDH1A1MEN1 | |
| SCHEMBL7239351 | 0.81 | PRSS12 (0.54) | NPSR1TP53PRSS12SMN1; SMN2KDM4E | |
| SCHEMBL6246675 | 0.80 | HDAC6 (0.72) | HDAC6NPSR1TP53ALDH1A1MEN1 | |
| SCHEMBL18573642 | 0.78 | NPC1 (0.63) | HDAC6TP53MAPTALDH1A1MEN1 | |
| SCHEMBL12900089 | 0.76 | FABP3 (0.50) | NPSR1TP53MAPTALDH1A1MEN1 | |
| SCHEMBL12758441 | 0.75 | KMT2A (0.60) | NPSR1TP53PRSS12ALDH1A1MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110028462-A1 | Niacin Receptor Agonists, compositions Containing Such Compounds and Methods of Treatment | MERCK SHARP & DOHME CORP. | 2011-02-03 | — | — | US | disclosed |
| US-20110028462-A1 | Niacin Receptor Agonists, compositions Containing Such Compounds and Methods of Treatment | MERCK SHARP & DOHME CORP. | 2011-02-03 | — | — | US | disclosed |
| WO-2007035478-A2 | NIACIN RECEPTOR AGONISTS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT | MERCK & CO., INC. (US) | 2007-03-29 | — | — | 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-20110028462-A1 | Niacin Receptor Agonists, compositions Containing Such Compounds and Methods of Treatment | LDLR, APOB, FFAR1 | HDAC6 3118/4885NPSR1 57/4885TP53 4041/4885 |
“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.