Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NAMPT | P43490 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | SPR | P35270 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20332646 | 0.98 | TACR1 (0.45) | TACR1PARP1HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL20332362 | 0.95 | TACR1 (0.45) | TACR1SMN1; SMN2NAMPTCYP3A4CYP2C19 | |
| SCHEMBL7556241 | 0.90 | PARP1 (0.51) | PARP1HPGDALDH1A1SMN1; SMN2NAMPT | |
| SCHEMBL20304310 | 0.90 | HPGD (0.51) | PARP1HPGDALDH1A1SMN1; SMN2NAMPT | |
| SCHEMBL20332623 | 0.89 | TACR1 (0.40) | TACR1ALDH1A1SMN1; SMN2NAMPTCYP3A4 | |
| SCHEMBL20304296 | 0.87 | ALDH1A1 (0.49) | TACR1PARP1HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL20332680 | 0.85 | TACR1 (0.38) | TACR1PARP1HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL20332113 | 0.84 | TRAP1 (0.44) | HPGDALDH1A1SMN1; SMN2NAMPTCYP2D6 | |
| SCHEMBL20332523 | 0.84 | HPGD (0.46) | PARP1HPGDALDH1A1SMN1; SMN2NAMPT | |
| SCHEMBL20304311 | 0.82 | CNR1 (0.41) | TACR1PARP1ALDH1A1SMN1; SMN2NAMPT |
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-20200069691-A1 | HETEROCYCLIC COMPOUNDS AS HIV PROTEASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2020-03-05 | — | — | US | claimed |
| US-20200069691-A1 | HETEROCYCLIC COMPOUNDS AS HIV PROTEASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2020-03-05 | — | — | US | disclosed |
| US-20200069691-A1 | HETEROCYCLIC COMPOUNDS AS HIV PROTEASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2020-03-05 | — | — | 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-20200069691-A1 | HETEROCYCLIC COMPOUNDS AS HIV PROTEASE INHIBITORS | SERPINB1, PREP, PEPD | TACR1 1970/4885PARP1 163/4885HPGD 231/4885 |
“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.