SCHEMBL14547723

SCHEMBL14547723

N#Cc1ccc(Nc2nc(NCC(F)(F)F)c3cc[nH]c3n2)cn1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 2/20 0.59
▸ CHEK1 O14757 19/20 0.54
▸ SGK1 O00141 1/20 0.54
▸ AURKA O14965 1/20 0.54
▸ DAPK3 O43293 1/20 0.54
▸ PRKAB2 O43741 1/20 0.54
▸ JAK2 O60674 1/20 0.54
▸ ROCK2 O75116 1/20 0.54
▸ PRKD3 O94806 1/20 0.54
▸ MAP4K4 O95819 1/20 0.54
▸ PAK4 O96013 1/20 0.54
▸ ABL1 P00519 1/20 0.54
▸ NTRK1 P04629 1/20 0.54
▸ INSR P06213 1/20 0.54
▸ LCK P06239 1/20 0.54
▸ FYN P06241 1/20 0.54
▸ CSF1R P07333 1/20 0.54
▸ RET P07949 1/20 0.54
▸ IGF1R P08069 1/20 0.54
▸ MET P08581 1/20 0.54

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
SCHEMBL14547958 0.82 LRRK2 (0.72) LRRK2CHEK1SGK1AURKADAPK3
SCHEMBL14547850 0.79 LRRK2 (0.62) LRRK2CHEK1SGK1AURKADAPK3
SCHEMBL14547935 0.79 LRRK2 (0.74) LRRK2CHEK1SGK1AURKADAPK3
SCHEMBL14547919 0.79 LRRK2 (0.70) LRRK2CHEK1SGK1AURKADAPK3
SCHEMBL14547965 0.78 LRRK2 (0.67) LRRK2CHEK1SGK1AURKADAPK3
SCHEMBL14547849 0.78 LRRK2 (0.69) LRRK2CHEK1SGK1AURKADAPK3
SCHEMBL14547949 0.76 LRRK2 (0.60) LRRK2CHEK1SGK1AURKADAPK3
SCHEMBL14287407 0.75 LRRK2 (0.82) LRRK2CHEK1SGK1AURKADAPK3
SCHEMBL14547966 0.75 LRRK2 (0.57) LRRK2CHEK1SGK1AURKADAPK3
SCHEMBL14547972 0.74 LRRK2 (0.74) LRRK2CHEK1SGK1AURKADAPK3

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-2007042299-A1 PYRROLOPYRIMIDINE DERIVATIVES AS SYK INHIBITORS GLAXO GROUP LIMITED (GB) 2007-04-19 — — WO disclosed
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