Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.48 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.41 |
| ▸ | BRD7 | Q9NPI1 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.34 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22607376 | 0.84 | ALDH1A1 (0.40) | ALDH1A1CYP2A6CYP2A13PCSK9EPHX2 | |
| SCHEMBL17127671 | 0.84 | ALDH1A1 (0.40) | ALDH1A1CYP2A6CYP2A13PCSK9EPHX2 | |
| SCHEMBL28310880 | 0.80 | PCSK9 (0.52) | ALDH1A1CYP2A6CYP2A13PCSK9EPHX2 | |
| SCHEMBL6067863 | 0.77 | ALDH1A1 (0.47) | ALDH1A1CYP2A6CYP2A13PCSK9EPHX2 | |
| SCHEMBL197196 | 0.75 | PCSK9 (0.60) | ALDH1A1CYP2A6CYP2A13PCSK9EPHX2 | |
| SCHEMBL16435780 | 0.75 | ALDH1A1 (0.42) | ALDH1A1CYP2A6CYP2A13PCSK9EPHX2 | |
| SCHEMBL6444709 | 0.75 | PCSK9 (0.73) | ALDH1A1CYP2A6CYP2A13PCSK9EPHX2 | |
| SCHEMBL3188837 | 0.74 | PCSK9 (0.50) | ALDH1A1CYP2A6CYP2A13PCSK9EPHX2 | |
| SCHEMBL18999650 | 0.74 | PCSK9 (0.46) | ALDH1A1CYP2A6CYP2A13PCSK9EPHX2 | |
| SCHEMBL20557374 | 0.74 | ALDH1A1 (0.49) | ALDH1A1CYP2A6CYP2A13PCSK9MAPT |
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-20170174689-A1 | SUBSTITUTED INDOLE MCL-1 INHIBITORS | VANDERBILT UNIVERSITY | 2017-06-22 | — | — | 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-20170174689-A1 | SUBSTITUTED INDOLE MCL-1 INHIBITORS | MCL1, BCL2L1, BCL3 | ALDH1A1 1900/4885CYP2A6 4451/4885CYP2A13 4769/4885 |
“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.