SCHEMBL13625299

SCHEMBL13625299

Nc1nccc(-c2cc(N)c(-c3ccc(Cl)cc3Cl)[nH]2)n1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 16/20 0.71
▸ CDC7 O00311 3/20 0.71
▸ CDK2 P24941 3/20 0.71
▸ CSNK1A1 P48729 3/20 0.71
▸ CSNK1D P48730 3/20 0.71
▸ CDK9 P50750 3/20 0.71
▸ CSNK2A1 P68400 3/20 0.71
▸ GSK3B P49841 3/20 0.71
▸ PLK4 O00444 2/20 0.71
▸ MAPK13 O15264 2/20 0.71
▸ DAPK3 O43293 2/20 0.71
▸ DYRK3 O43781 2/20 0.71
▸ PRKD3 O94806 2/20 0.71
▸ CHEK2 O96017 2/20 0.71
▸ PRKCG P05129 2/20 0.71
▸ CDK1 P06493 2/20 0.71
▸ PRKACA P17612 2/20 0.71
▸ MARK3 P27448 2/20 0.71
▸ MAPK1 P28482 2/20 0.71
▸ FRK P42685 2/20 0.71

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
SCHEMBL1134007 0.84 JAK2 (0.65) JAK2CDC7CDK2CSNK1A1CSNK1D
SCHEMBL1207892 0.83 JAK2 (0.84) JAK2CDC7CDK2CSNK1A1CSNK1D
SCHEMBL1133999 0.83 JAK2 (1.00) JAK2CDC7CDK2CSNK1A1CSNK1D
SCHEMBL13977717 0.83 JAK2 (0.72) JAK2CDC7CDK2CSNK1A1CSNK1D
SCHEMBL15300558 0.81 JAK2 (0.72) JAK2CDC7CDK2CSNK1A1CSNK1D
SCHEMBL1759878 0.80 MAPT (0.72) JAK2CDC7CDK2CSNK1A1CSNK1D
SCHEMBL4181635 0.78 JAK2 (0.73) JAK2CDC7CDK2CSNK1A1CSNK1D
SCHEMBL13732436 0.74 JAK2 (1.00) JAK2CDC7CDK2CSNK1A1CSNK1D
SCHEMBL1208304 0.73 JAK2 (0.82) JAK2CDC7CDK2CSNK1A1CSNK1D
SCHEMBL4191117 0.73 JAK2 (0.69) JAK2CDC7CDK2CSNK1A1CSNK1D

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
WO-2009133170-A1 PROCESS FOR THE PREPARATION OF 5-(2-AMINO-PYRIMIDIN-4-YL)-2-ARYL-1H-PYRROLE-3-CARBOXAMIDES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-11-05 — — WO disclosed
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