SCHEMBL21177643

SCHEMBL21177643

CCOC(=O)C(C)(C)c1cc(NCc2cccc(-c3nccn3C)c2)n2nc(C)c(I)c2n1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
MAPT P10636 3/20 0.39
HSP90AA1 P07900 2/20 0.39
PI4KB Q9UBF8 10/20 0.37
RIPK2 O43353 1/20 0.34
GSK3B P49841 1/20 0.34
NMT1 P30419 1/20 0.34
TP53 P04637 1/20 0.33
KCNN3 Q9UGI6 1/20 0.33
GPR119 Q8TDV5 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL21189621 0.93 KDM4E (0.40) KDM4EMAPTHSP90AA1PI4KBRIPK2
SCHEMBL21177178 0.88 KDM4E (0.43) KDM4EMAPTHSP90AA1PI4KBRIPK2
SCHEMBL21177328 0.87 KDM4E (0.42) KDM4EMAPTHSP90AA1PI4KBRIPK2
SCHEMBL21179415 0.86 GSK3B (0.48) KDM4EMAPTHSP90AA1PI4KBRIPK2
SCHEMBL21177410 0.85 KDM4E (0.37) KDM4EMAPTHSP90AA1PI4KBRIPK2
SCHEMBL24108584 0.84 GSK3B (0.40) KDM4EMAPTHSP90AA1PI4KBRIPK2
SCHEMBL21179393 0.84 KDM4E (0.38) KDM4EMAPTHSP90AA1PI4KBGSK3B
SCHEMBL21177429 0.84 KDM4E (0.40) KDM4EMAPTHSP90AA1PI4KBRIPK2
SCHEMBL21177217 0.83 KCNN3 (0.47) KDM4EMAPTHSP90AA1PI4KBNMT1
SCHEMBL21179408 0.80 KDM4E (0.42) KDM4EMAPTHSP90AA1PI4KBRIPK2

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240336618-A1 PI4KIIIBETA INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2024-10-10 US disclosed
US-11649238-B2 Substituted pyrazolo[1,5-a]pyrimidines as PI4K inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-05-16 US disclosed
US-11649238-B2 Substituted pyrazolo[1,5-a]pyrimidines as PI4K inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-05-16 US disclosed
US-11649238-B2 Substituted pyrazolo[1,5-a]pyrimidines as PI4K inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-05-16 US disclosed
US-20230124394-A1 PI4KIIIBETA INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-04-20 US disclosed
US-20230124394-A1 PI4KIIIBETA INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-04-20 US disclosed
US-20210387988-A1 PI4KIIIbeta Inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-12-16 US disclosed
US-20210387988-A1 PI4KIIIbeta Inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-12-16 US disclosed
EP-3740489-A1 PI4KIIIBETA INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2020-11-25 EP disclosed
WO-2019141694-A1 PI4KIIIBETA INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-07-25 WO disclosed
WO-2019141694-A1 PI4KIIIBETA INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-07-25 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 (4 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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230124394-A1 PI4KIIIBETA INHIBITORS PI4KB, PI4K2B, PI4K2A KDM4E 691/4885MAPT 2882/4885HSP90AA1 2570/4885
US-11649238-B2 Substituted pyrazolo[1,5-a]pyrimidines as PI4K inhibitors PI4K2A, PI4K2B, PI4KA KDM4E 577/4885MAPT 2830/4885HSP90AA1 3981/4885
US-20240336618-A1 PI4KIIIBETA INHIBITORS PI4KB, PI4K2B, PI4K2A KDM4E 692/4885MAPT 2958/4885HSP90AA1 2713/4885
US-20210387988-A1 PI4KIIIbeta Inhibitors PI4KB, PI4K2B, PI4K2A KDM4E 692/4885MAPT 2958/4885HSP90AA1 2713/4885

“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.