SCHEMBL2383138

SCHEMBL2383138

Clc1cncc(Cl)c1-c1nc2ccnc(Nc3ccncn3)c2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 18/20 0.56
TYK2 P29597 18/20 0.56
CDK2 P24941 2/20 0.37
CCNA2 P20248 1/20 0.37
CCNA1 P78396 1/20 0.37
JAK1 P23458 2/20 0.36
CDK9 P50750 1/20 0.36
JAK3 P52333 1/20 0.36
PIK3C3 Q8NEB9 1/20 0.33

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
SCHEMBL12294920 0.85 TYK2 (0.57) JAK2TYK2CDK2JAK1CDK9
SCHEMBL2372525 0.84 TYK2 (0.58) JAK2TYK2CDK2JAK1CDK9
SCHEMBL2371779 0.84 JAK2 (0.60) JAK2TYK2CDK2CCNA2CCNA1
SCHEMBL12295360 0.84 JAK2 (0.60) JAK2TYK2
SCHEMBL2371815 0.83 TYK2 (0.53) JAK2TYK2CDK2CCNA2CCNA1
SCHEMBL2371764 0.82 TYK2 (0.43) JAK2TYK2CDK2JAK1CDK9
SCHEMBL14858434 0.82 TYK2 (0.48) JAK2TYK2CDK2JAK1CDK9
SCHEMBL12294570 0.80 TYK2 (0.47) JAK2TYK2CDK2JAK1CDK9
SCHEMBL14858365 0.77 JAK2 (0.47) JAK2TYK2CDK9
SCHEMBL2372568 0.77 TYK2 (0.48) JAK2TYK2JAK1

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-2547338-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. Hoffmann-La Roche AG (CH) 2013-01-23 EP disclosed
WO-2011113802-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2011-09-22 WO disclosed