SCHEMBL5216017

SCHEMBL5216017

CCOc1cc(NC2CCCC2)cc2c(-c3ccnc(NC4CCCC4)n3)c(-c3ccc(F)cc3)nn12

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.46
MAPK14 Q16539 5/20 0.43
GSK3B P49841 5/20 0.43
MAPK13 O15264 1/20 0.42
MAPK12 P53778 1/20 0.42
MAPK11 Q15759 1/20 0.42
CDK4 P11802 1/20 0.42
MAPK10 P53779 2/20 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
SCHEMBL5216364 0.91 CSNK1D (0.44) CSNK1DMAPK14GSK3BMAPK13MAPK12
SCHEMBL5216644 0.87 CSNK1D (0.49) CSNK1DMAPK14GSK3BMAPK13MAPK12
SCHEMBL5215590 0.86 CSNK1D (0.46) CSNK1DMAPK14GSK3BMAPK13MAPK12
SCHEMBL5890227 0.85 CSNK1D (0.49) CSNK1DMAPK14GSK3BMAPK13MAPK12
SCHEMBL5215526 0.85 CSNK1D (0.47) CSNK1DMAPK14GSK3BMAPK13MAPK12
SCHEMBL5217719 0.83 CSNK1D (0.46) CSNK1DMAPK14GSK3BMAPK13MAPK12
SCHEMBL5890439 0.81 CSNK1D (0.47) CSNK1DMAPK14GSK3BMAPK13MAPK12
SCHEMBL5214451 0.81 CSNK1D (0.51) CSNK1DMAPK14GSK3BMAPK13MAPK12
SCHEMBL5875488 0.80 CSNK1D (0.46) CSNK1DMAPK14GSK3BMAPK13MAPK12
SCHEMBL5890649 0.80 CSNK1D (0.51) CSNK1DMAPK14GSK3BMAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423389-B1 PYRAZOLO-PYRIDINES FOR THE TREATMENT OF HERPES INFECTIONS SMITHKLINE BEECHAM CORP (US) 2007-06-06 EP claimed
EP-1423389-B1 PYRAZOLO-PYRIDINES FOR THE TREATMENT OF HERPES INFECTIONS SMITHKLINE BEECHAM CORP (US) 2007-06-06 EP disclosed