SCHEMBL3300680

SCHEMBL3300680

CNC(=O)c1ccc(Nc2nc3ccnc(Cc4cccc(O)c4)n3n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 4/20 0.42
JAK2 O60674 5/20 0.42
CDK2 P24941 3/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
SCN9A Q15858 5/20 0.40
MET P08581 2/20 0.40
JAK3 P52333 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
SCHEMBL2144655 0.88 JAK2 (0.45) PTK2JAK2MKNK1MKNK2SCN9A
SCHEMBL3309011 0.83 JAK2 (0.43) PTK2JAK2CDK2MKNK1MKNK2
SCHEMBL2144323 0.78 JAK2 (0.55) PTK2JAK2JAK3
SCHEMBL3303379 0.77 MKNK1 (0.47) PTK2JAK2CDK2MKNK1MKNK2
SCHEMBL3304954 0.74 JAK2 (0.44) PTK2JAK2CDK2METJAK3
SCHEMBL3304413 0.74 CDK2 (0.50) JAK2CDK2MKNK1MKNK2SCN9A
SCHEMBL3300544 0.74 JAK2 (0.44) PTK2JAK2CDK2MKNK1MKNK2
SCHEMBL3300279 0.73 CDK2 (0.43) PTK2JAK2CDK2MKNK1MKNK2
SCHEMBL2144888 0.73 JAK2 (0.52) PTK2JAK2JAK3
SCHEMBL2144680 0.73 JAK2 (0.51) PTK2JAK2CDK2MKNK1MKNK2

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-20130005707-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BAHMANYAR SOGOLE (US) 2013-01-03 US disclosed
US-8299056-B2 Aminotriazolopyridines, compositions thereof, and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC (US) 2012-10-30 US disclosed
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2010-04-15 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 (2 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-20130005707-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 PTK2 220/4885JAK2 26/4885CDK2 37/4885
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 PTK2 220/4885JAK2 26/4885CDK2 37/4885

“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.