SCHEMBL3939475

SCHEMBL3939475

Cc1cc(Nc2nc(Cl)nc(Cl)n2)n[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PAK4 O96013 5/20 0.56
▸ PLK4 O00444 4/20 0.56
▸ AURKA O14965 10/20 0.53
▸ AURKB Q96GD4 4/20 0.53
▸ FGFR1 P11362 3/20 0.53
▸ GSK3B P49841 2/20 0.53
▸ JAK2 O60674 2/20 0.53
▸ RET P07949 2/20 0.53
▸ IGF1R P08069 2/20 0.53
▸ KDR P35968 2/20 0.53
▸ FLT3 P36888 2/20 0.53
▸ JAK3 P52333 2/20 0.53
▸ PTK2 Q05397 2/20 0.53
▸ TNK2 Q07912 2/20 0.53
▸ DAPK3 O43293 1/20 0.53
▸ ABL1 P00519 1/20 0.53
▸ LCK P06239 1/20 0.53
▸ FYN P06241 1/20 0.53
▸ CSF1R P07333 1/20 0.53
▸ PDGFRB P09619 1/20 0.53

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
SCHEMBL10294569 0.86 PAK4 (0.49) PAK4PLK4AURKAAURKBFGFR1
SCHEMBL10294568 0.80 AURKA (0.56) AURKAAURKB
SCHEMBL343410 0.79 PAK4 (0.54) PAK4PLK4AURKAAURKBFGFR1
SCHEMBL220647 0.79 PAK4 (0.57) PAK4PLK4AURKAAURKBFGFR1
SCHEMBL10312057 0.79 AURKA (0.51) PAK4PLK4AURKAAURKBFGFR1
SCHEMBL3936147 0.79 NTRK1 (0.60) AURKAAURKBJAK2IGF1RJAK3
SCHEMBL21925754 0.79 AURKA (0.47) PAK4PLK4AURKAAURKBFGFR1
SCHEMBL219046 0.78 PAK4 (0.59) PAK4PLK4AURKAAURKBFGFR1
SCHEMBL588674 0.77 PAK4 (0.62) PAK4PLK4AURKAAURKBFGFR1
SCHEMBL22600946 0.74 PAK4 (0.59) PAK4PLK4AURKAAURKBFGFR1

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-2009016410-A2 CHEMICAL COMPOUNDS 831 ASTRAZENECA AB (SE) 2009-02-05 — — WO disclosed
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