SCHEMBL29437817

SCHEMBL29437817

NC(=O)c1ccccc1CNc1ncc(-c2ccc3[nH]c(=O)[nH]c3c2)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MKNK2 Q9HBH9 3/20 0.44
▸ MKNK1 Q9BUB5 1/20 0.44
▸ GAA P10253 4/20 0.42
▸ MAPT P10636 4/20 0.42
▸ KDM4E B2RXH2 2/20 0.39
▸ MAP4K4 O95819 2/20 0.39
▸ GSK3B P49841 2/20 0.39
▸ CLK4 Q9HAZ1 2/20 0.39
▸ PLK4 O00444 1/20 0.39
▸ CHEK1 O14757 1/20 0.39
▸ PRKD3 O94806 1/20 0.39
▸ CDK1 P06493 1/20 0.39
▸ LYN P07948 1/20 0.39
▸ RET P07949 1/20 0.39
▸ PIM1 P11309 1/20 0.39
▸ FER P16591 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ MARK3 P27448 1/20 0.39
▸ FLT4 P35916 1/20 0.39
▸ KDR P35968 1/20 0.39

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
SCHEMBL29664810 0.84 GAA (0.45) MKNK2MKNK1GAAMAPTKDM4E
SCHEMBL22190817 0.82 GAA (0.54) MKNK2GAAMAPTMAP4K4GSK3B
SCHEMBL22190920 0.82 GAA (0.64) MKNK2MKNK1GAAMAPTKDM4E
SCHEMBL22191453 0.81 VNN1 (0.52) PDE3BPDE3AVNN1DYRK1AHDAC3
SCHEMBL22191078 0.80 VNN1 (0.54) MKNK2MKNK1GSK3BCLK4PLK4
SCHEMBL29437806 0.80 DYRK1A (0.48) MKNK2GAAMAPTKDM4EMAP4K4
SCHEMBL22191264 0.80 DYRK1A (0.48) MKNK2GAAMAPTKDM4EMAP4K4
SCHEMBL22191095 0.80 PLK4 (0.50) MKNK2GAAMAPTMAP4K4GSK3B
SCHEMBL28644765 0.78 PLK4 (0.55) MKNK2GAAMAPTKDM4EMAP4K4
SCHEMBL22191699 0.76 HDAC3 (0.47) MKNK2GAAMAPTMAP4K4GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220064146-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-03-03 — — 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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220064146-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE CSNK1A1, MAP3K20, CSNK1G3 MKNK2 150/4885MKNK1 124/4885GAA 1058/4885

“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.

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