Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 20/20 | 1.00 |
| ▸ | CDK2 | P24941 | 18/20 | 1.00 |
| ▸ | CDK6 | Q00534 | 18/20 | 1.00 |
| ▸ | CDK1 | P06493 | 9/20 | 1.00 |
| ▸ | CDK7 | P50613 | 6/20 | 1.00 |
| ▸ | CDK9 | P50750 | 6/20 | 1.00 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.88 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.88 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.84 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.84 |
| ▸ | CCND3 | P30281 | 2/20 | 0.84 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.84 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.84 |
| ▸ | JAK2 | O60674 | 1/20 | 0.84 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.84 |
| ▸ | EGFR | P00533 | 1/20 | 0.84 |
| ▸ | RAF1 | P04049 | 1/20 | 0.84 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.84 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.84 |
| ▸ | SRC | P12931 | 1/20 | 0.84 |
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 | |
|---|---|---|---|---|
| SCHEMBL17477268 | 0.96 | CDK4 (0.92) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL19089098 | 0.93 | CDK4 (0.91) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL17485310 | 0.93 | CDK4 (1.00) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL19089283 | 0.93 | CDK4 (0.86) | CDK4CDK2CDK6CDK1CDK7 | |
| Hydrochloric Acid SCHEMBL20548753 | 0.93 | CDK4 (0.90) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL19089288 | 0.92 | CDK4 (0.86) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL19089009 | 0.92 | CDK4 (1.00) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL17477262 | 0.92 | CDK4 (1.00) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL22280791 | 0.92 | CDK4 (0.89) | CDK4CDK2CDK6CDK1CDK7 | |
| SCHEMBL22010446 | 0.91 | CDK4 (0.85) | CDK4CDK2CDK6CDK1CDK7 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10988476-B2 | Substituted pyrimidines as cyclin-dependent kinase inhibitors | SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) | 2021-04-27 | — | — | US | disclosed |
| US-20200239470-A1 | Substituted Pyrimidine Compound for Treating Cancer | SHANGHAI PHARMACEUTICALS HOLDING CO LTD (CN) | 2020-07-30 | — | — | US | disclosed |
| US-10662186-B2 | Substituted pyrimidines as cyclin-dependent kinase inhibitors | SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) | 2020-05-26 | — | — | US | disclosed |
| WO-2017114512-A1 | NITROGEN-CONTAINING FUSED HETEROCYCLIC COMPOUND, AS WELL AS PREPARATION METHOD, INTERMEDIATE, COMPOSITION AND APPLICATION THEREOF | 上海医药集团股份有限公司 | 2017-07-06 | — | — | WO | disclosed |
| WO-2016192630-A1 | COMPOUND HAVING KINASE INHIBITING ACTIVITY, METHOD OF PREPARING SAME, AND USE OF SAME | 中国科学院上海药物研究所 | 2016-12-08 | — | — | WO | disclosed |
| WO-2016015604-A1 | COMPOUNDS AS CDK SMALL-MOLECULE INHIBITORS AND USES THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-02-04 | — | — | WO | disclosed |
| WO-2016015604-A1 | COMPOUNDS AS CDK SMALL-MOLECULE INHIBITORS AND USES THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-02-04 | — | — | 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 (3 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-20200239470-A1 | Substituted Pyrimidine Compound for Treating Cancer | DPYD, TYMP, TYMS | CDK4 93/4885CDK2 112/4885CDK6 129/4885 |
| US-10662186-B2 | Substituted pyrimidines as cyclin-dependent kinase inhibitors | CDK6, CDK4, CCNI | CDK4 2/4885CDK2 6/4885CDK6 1/4885 |
| US-10988476-B2 | Substituted pyrimidines as cyclin-dependent kinase inhibitors | CDK1, CCNI, CDK2 | CDK4 5/4885CDK2 3/4885CDK6 9/4885 |
“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.