SCHEMBL7963634

SCHEMBL7963634

Nc1ccc(Nc2nc3cccc(-c4cccc(F)c4)n3n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 18/20 0.53
JAK3 P52333 9/20 0.52
PTK2 Q05397 8/20 0.52
JAK1 P23458 1/20 0.47
EGLN2 Q96KS0 1/20 0.46

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
SCHEMBL7975073 0.92 JAK2 (0.53) JAK2JAK3PTK2JAK1
SCHEMBL13486894 0.89 JAK2 (0.53) JAK2JAK3PTK2JAK1EGLN2
SCHEMBL2144914 0.89 JAK2 (0.56) JAK2JAK3PTK2JAK1EGLN2
SCHEMBL7977784 0.88 JAK2 (0.60) JAK2JAK3PTK2JAK1
SCHEMBL3214565 0.88 JAK2 (0.60) JAK2JAK3PTK2EGLN2
SCHEMBL3203477 0.87 JAK2 (0.53) JAK2JAK3PTK2JAK1EGLN2
SCHEMBL3204783 0.86 JAK2 (0.53) JAK2JAK3PTK2JAK1
SCHEMBL13276297 0.85 JAK2 (0.66) JAK2JAK3PTK2JAK1
SCHEMBL3200315 0.85 JAK2 (0.66) JAK2JAK3PTK2JAK1
SCHEMBL16248911 0.84 JAK2 (0.56) 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 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