Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | CASP7 | P55210 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30018039 | 0.92 | MCL1 (0.47) | MCL1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL12546789 | 0.86 | CYP3A4 (0.43) | MCL1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL5987112 | 0.84 | CYP3A4 (0.45) | MCL1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL27938872 | 0.84 | MCL1 (0.58) | MCL1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL29286601 | 0.84 | MCL1 (0.60) | MCL1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL20563591 | 0.84 | CYP3A4 (0.42) | MCL1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL19783419 | 0.84 | MCL1 (0.41) | MCL1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL21167302 | 0.81 | CA12 (0.43) | MCL1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL19753579 | 0.81 | CYP3A4 (0.44) | MCL1CYP3A4HSD17B10CASP1CASP7 | |
| SCHEMBL1301705 | 0.81 | CYP3A4 (0.62) | MCL1CYP3A4HSD17B10CASP1CASP7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114040959-A | Photochromic and electrochromic diarylethene compounds with improved photostability and solubility | 首诺加拿大公司 | 2022-02-11 | — | — | CN | disclosed |
| US-8598168-B2 | Inhibitors of histone deacetylase | METHYLGENE INC. (CA) | 2013-12-03 | — | — | US | disclosed |
| US-20080132503-A1 | Inhibitors of Histone Deacetylase | METHYLGENE INC. (CA) | 2008-06-05 | — | — | 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-20080132503-A1 | Inhibitors of Histone Deacetylase | HDAC1, HDAC5, HDAC3 | MCL1 262/4885CYP3A4 4739/4885HSD17B10 464/4885 |
“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.