SCHEMBL3655545

SCHEMBL3655545

NC(=O)Cc1ccc(Nc2nc3cccc(Br)n3n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 11/20 0.44
JAK3 P52333 9/20 0.44
PTK2 Q05397 9/20 0.44
PDE4B Q07343 3/20 0.42
JAK1 P23458 1/20 0.42
SRC P12931 1/20 0.41
WEE1 P30291 1/20 0.41
NEK2 P51955 1/20 0.40
FLT3 P36888 1/20 0.39
KDM4E B2RXH2 1/20 0.39
THRB P10828 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL3303680 0.84 JAK2 (0.49) JAK2JAK3PTK2PDE4BJAK1
SCHEMBL3262347 0.80 JAK2 (0.61) JAK2JAK3PTK2JAK1THRB
SCHEMBL3263724 0.79 JAK2 (0.45) JAK2JAK3PTK2JAK1KDM4E
SCHEMBL3261713 0.79 JAK1 (0.64) JAK2JAK3PTK2JAK1FLT3
SCHEMBL3266110 0.78 JAK2 (0.55) JAK2JAK3PTK2JAK1KDM4E
SCHEMBL3262435 0.77 JAK2 (0.55) JAK2JAK3PTK2JAK1KDM4E
SCHEMBL2144680 0.77 JAK2 (0.51) JAK2JAK3PTK2JAK1
SCHEMBL7964132 0.76 JAK2 (0.49) JAK2JAK3PTK2JAK1NEK2
SCHEMBL7974556 0.76 MEN1 (0.55) JAK2JAK1KDM4ETHRBNPSR1
SCHEMBL3261150 0.74 PLK1 (0.47) JAK2JAK3PTK2JAK1KDM4E

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-2010010188-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES. GALAPAGOS NV (BE) 2010-01-28 WO disclosed