SCHEMBL12295652

SCHEMBL12295652

Cc1cc(Nc2ncnc3[nH]c(-c4c(Cl)cccc4Cl)nc23)ncc1N

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 20/20 0.56
JAK2 O60674 19/20 0.56
JAK1 P23458 1/20 0.42
CDK2 P24941 1/20 0.42
CDK9 P50750 1/20 0.42
JAK3 P52333 1/20 0.42

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
SCHEMBL2372599 0.86 TYK2 (0.52) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2371303 0.84 TYK2 (0.76) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2372031 0.82 TYK2 (0.60) TYK2JAK2JAK1CDK2CDK9
SCHEMBL12296301 0.79 JAK2 (0.62) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2372650 0.79 JAK2 (0.51) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2372085 0.79 JAK2 (0.50) TYK2JAK2
SCHEMBL2372145 0.78 TYK2 (0.61) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2372399 0.78 JAK2 (0.60) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2372221 0.78 JAK2 (0.56) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2371587 0.77 TYK2 (0.60) TYK2JAK2JAK1CDK2CDK9

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-2011113802-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2011-09-22 WO disclosed