SCHEMBL2144584

SCHEMBL2144584

FC(F)(F)c1ccc(Nc2nc3cccc(CN4CCCC4)n3n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 16/20 0.46
JAK3 P52333 15/20 0.46
PTK2 Q05397 15/20 0.46
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
SLC2A1 P11166 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
JAK1 P23458 1/20 0.40
FLT3 P36888 1/20 0.40
TYRO3 Q06418 1/20 0.40
MERTK Q12866 1/20 0.40
GAS6 Q14393 1/20 0.40

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
SCHEMBL2144500 0.99 JAK2 (0.46) JAK2JAK3PTK2KDM4EALDH1A1
SCHEMBL2145387 0.91 PTK2 (0.46) JAK2JAK3PTK2JAK1
SCHEMBL2145026 0.90 PTK2 (0.48) JAK2JAK3PTK2JAK1
SCHEMBL2143973 0.90 JAK2 (0.51) JAK2JAK3PTK2SLC2A1JAK1
SCHEMBL2144031 0.89 JAK2 (0.44) JAK2JAK3PTK2JAK1FLT3
SCHEMBL3303823 0.87 JAK2 (0.47) JAK2JAK3PTK2ALDH1A1JAK1
SCHEMBL3305501 0.87 JAK2 (0.47) JAK2JAK3PTK2ALDH1A1JAK1
SCHEMBL3303815 0.87 JAK2 (0.47) JAK2JAK3PTK2ALDH1A1JAK1
SCHEMBL3304372 0.87 FAAH (0.44) JAK2JAK3PTK2SIGMAR1JAK1
SCHEMBL2145289 0.87 JAK2 (0.46) JAK2JAK3PTK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2344494-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS Signal Pharmaceuticals, LLC (US) 2011-07-20 EP claimed
WO-2010027500-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2010-03-11 WO claimed
EP-2344494-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS Signal Pharmaceuticals, LLC (US) 2011-07-20 EP disclosed
WO-2010027500-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2010-03-11 WO disclosed