Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.41 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1607866 | 0.83 | TP53 (0.55) | ALDH1A1SMN1; SMN2CYP3A4MAPTGAA | |
| SCHEMBL940807 | 0.83 | TP53 (0.55) | ALDH1A1SMN1; SMN2CYP3A4MAPTGAA | |
| Hydrochloric Acid SCHEMBL11722776 | 0.81 | TP53 (0.53) | ALDH1A1SMN1; SMN2CYP3A4MAPTGAA | |
| SCHEMBL6086071 | 0.81 | SMN1; SMN2 (0.63) | ALDH1A1TSHRSMN1; SMN2CYP3A4MAPT | |
| Hydrochloric Acid SCHEMBL11722772 | 0.81 | TP53 (0.53) | ALDH1A1SMN1; SMN2CYP3A4MAPTGAA | |
| SCHEMBL287220 | 0.81 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2CYP3A4MAPTGAA | |
| SCHEMBL20524695 | 0.81 | MAPT (0.49) | ALDH1A1TSHRSMN1; SMN2CYP3A4MAPT | |
| SCHEMBL11719928 | 0.80 | KMT2A (0.51) | ALDH1A1SMN1; SMN2CYP3A4MAPTGAA | |
| SCHEMBL11725136 | 0.79 | MAPT (0.54) | ALDH1A1SMN1; SMN2CYP3A4MAPTGAA | |
| SCHEMBL54880 | 0.78 | ALDH1A1 (0.66) | ALDH1A1TSHRSMN1; SMN2CYP3A4MEN1 |
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-9303044-B2 | 7-(piperazin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-A]pyrimidin-5-ones for the treatment of thrombotic disorders | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2016-04-05 | — | — | US | disclosed |
| US-20150050325-A1 | ORGANIC COMPOUNDS | THE ROCKEFELLER UNIVERSITY (US) | 2015-02-19 | — | — | US | disclosed |
| US-4053608-A | 3-NITROPYRIDINE CARBOXAMIDES, POULTRY FEED | SANKYO COMPANY LIMITED (JA) | 1977-10-11 | — | — | 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-20150050325-A1 | ORGANIC COMPOUNDS | VCAM1, ICAM1, PLAT | ALDH1A1 426/4885TSHR 4812/4885SMN1; SMN2 337/4885 |
“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.