SCHEMBL3300544

SCHEMBL3300544

CNC(=O)c1ccc(Nc2nc3ccnc(-c4cc(O)cc(Cl)c4)n3n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.44
CDK2 P24941 7/20 0.40
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
ABL1 P00519 1/20 0.37
PDGFRB P09619 1/20 0.37
BCR P11274 1/20 0.37
PDGFRA P16234 1/20 0.37
JAK1 P23458 2/20 0.37
SRC P12931 1/20 0.37
PTK2 Q05397 2/20 0.36
SCN9A Q15858 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL3299894 0.87 JAK2 (0.52) JAK2JAK1PTK2
SCHEMBL3309011 0.87 JAK2 (0.43) JAK2CDK2MKNK1MKNK2JAK1
SCHEMBL3304749 0.84 JAK2 (0.41) JAK2CDK2MKNK1MKNK2ABL1
SCHEMBL3303379 0.77 MKNK1 (0.47) JAK2CDK2MKNK1MKNK2PTK2
SCHEMBL2143971 0.76 JAK2 (0.53) JAK2JAK1PTK2
SCHEMBL2145076 0.75 JAK2 (0.56) JAK2JAK1PTK2
SCHEMBL2144323 0.74 JAK2 (0.55) JAK2JAK1PTK2
SCHEMBL3300680 0.74 PTK2 (0.42) JAK2CDK2MKNK1MKNK2PTK2
SCHEMBL3205653 0.73 JAK2 (0.61) JAK2JAK1PTK2
SCHEMBL2144887 0.71 JAK2 (0.46) JAK2JAK1PTK2

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 JAK2 26/4885CDK2 37/4885MKNK1 100/4885
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 JAK2 26/4885CDK2 37/4885MKNK1 100/4885

“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.