SCHEMBL18609486

SCHEMBL18609486

N#Cc1ccc(-c2cnc3ccc(-c4ccncc4)cn23)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 6/20 0.57
MKNK2 Q9HBH9 6/20 0.57
CYP3A4 P08684 1/20 0.57
EIF4E P06730 1/20 0.57
PIK3CA P42336 5/20 0.53
MTOR P42345 3/20 0.53
CHEK1 O14757 2/20 0.47
GSK3B P49841 1/20 0.47
CYP11B2 P19099 2/20 0.45
CYP11B1 P15538 1/20 0.45
KDR P35968 1/20 0.44
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
FYN P06241 1/20 0.43
DYRK1A Q13627 1/20 0.41
KCNH2 Q12809 1/20 0.41

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
SCHEMBL20146927 0.83 MKNK1 (0.57) MKNK1MKNK2CYP3A4EIF4EPIK3CA
SCHEMBL19243881 0.83 MKNK1 (0.57) MKNK1MKNK2CYP3A4EIF4ECHEK1
SCHEMBL15288077 0.82 MKNK1 (0.68) MKNK1MKNK2CYP3A4EIF4EPIK3CA
SCHEMBL15288657 0.82 MKNK1 (0.59) MKNK1MKNK2CYP3A4EIF4EPIK3CA
SCHEMBL15288730 0.81 MKNK1 (0.52) MKNK1MKNK2CYP3A4EIF4EPIK3CA
SCHEMBL20146929 0.79 MKNK1 (0.52) MKNK1MKNK2CYP3A4EIF4EPIK3CA
SCHEMBL15288936 0.79 MKNK1 (0.75) MKNK1MKNK2CYP3A4EIF4E
SCHEMBL16304108 0.78 MKNK1 (0.69) MKNK1MKNK2CYP3A4EIF4E
SCHEMBL18609283 0.78 PIK3CA (0.70) PIK3CAMTORCHEK1GSK3BKDR
SCHEMBL14668413 0.77 PIK3CA (0.53) MKNK1MKNK2CYP3A4EIF4EPIK3CA

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10730842-B2 Small molecule inhibitors of DYRK1A and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2020-08-04 US disclosed
US-10730842-B2 Small molecule inhibitors of DYRK1A and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2020-08-04 US disclosed
WO-2017040993-A1 SMALL MOLECULE INHIBITORS OF DYRK1A AND USES THEREOF THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2017-03-09 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 (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.

PatentTitleText reads most aboutPredicted target · text-rank
US-10730842-B2 Small molecule inhibitors of DYRK1A and uses thereof DYRK1A, DYRK2, DYRK1B MKNK1 125/4885MKNK2 165/4885CYP3A4 4528/4885

“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.