SCHEMBL21177213

SCHEMBL21177213

Cc1nn2c(OC(=O)NCc3cccc(-c4nccn4C)c3)cc(CO)nc2c1I

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.37
LMNA P02545 2/20 0.34
RIPK2 O43353 1/20 0.34
BRD4 O60885 1/20 0.34
MAPK14 Q16539 1/20 0.33
SMO Q99835 1/20 0.33
NMT1 P30419 1/20 0.33
TP53 P04637 2/20 0.33
NTRK1 P04629 1/20 0.33
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
EPHX1 P07099 2/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
PDK1 Q15118 1/20 0.31
NAMPT P43490 2/20 0.31

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
SCHEMBL21177363 0.90 THRB (0.36) THRBLMNARIPK2BRD4MAPK14
SCHEMBL21177535 0.87 THRB (0.36) THRBLMNARIPK2BRD4MAPK14
SCHEMBL21177211 0.78 PDK1 (0.41) LMNARIPK2MAPK14SMONMT1
SCHEMBL21179393 0.75 KDM4E (0.38) THRBTP53POLBKMT2A
SCHEMBL30391515 0.75 PDK1 (0.34) RIPK2MAPK14SMONMT1PDK1
SCHEMBL21189441 0.75 PDK1 (0.34) RIPK2MAPK14SMONMT1PDK1
SCHEMBL21177217 0.74 KCNN3 (0.47) NMT1TP53
SCHEMBL21179415 0.73 GSK3B (0.48) RIPK2TP53
SCHEMBL21177328 0.73 KDM4E (0.42) RIPK2NMT1KMT2A
SCHEMBL21179408 0.72 KDM4E (0.42) THRBLMNARIPK2NMT1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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

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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230124394-A1 PI4KIIIBETA INHIBITORS PI4KB, PI4K2B, PI4K2A THRB 1154/4885LMNA 2844/4885RIPK2 177/4885
US-11649238-B2 Substituted pyrazolo[1,5-a]pyrimidines as PI4K inhibitors PI4K2A, PI4K2B, PI4KA THRB 1678/4885LMNA 2522/4885RIPK2 158/4885
US-20210387988-A1 PI4KIIIbeta Inhibitors PI4KB, PI4K2B, PI4K2A THRB 1115/4885LMNA 2673/4885RIPK2 173/4885

“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.