SCHEMBL14547932

SCHEMBL14547932

O=C(c1ccc(Nc2nc(NCC(F)(F)F)c3cc[nH]c3n2)cc1F)N1CCOCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 12/20 0.56
▸ PTK2 Q05397 3/20 0.51
▸ JAK3 P52333 3/20 0.51
▸ BTK Q06187 3/20 0.51
▸ JAK2 O60674 2/20 0.51
▸ ABL1 P00519 2/20 0.51
▸ INSR P06213 2/20 0.51
▸ LCK P06239 2/20 0.51
▸ FYN P06241 2/20 0.51
▸ RET P07949 2/20 0.51
▸ MST1 P26927 2/20 0.51
▸ TTK P33981 2/20 0.51
▸ SYK P43405 2/20 0.51
▸ MAPK8 P45983 2/20 0.51
▸ TNK2 Q07912 2/20 0.51
▸ MAP4K2 Q12851 2/20 0.51
▸ NTRK2 Q16620 2/20 0.51
▸ SGK1 O00141 1/20 0.51
▸ CHEK1 O14757 1/20 0.51
▸ AURKA O14965 1/20 0.51

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
SCHEMBL14547779 0.92 LRRK2 (0.58) LRRK2PTK2JAK3BTKJAK2
SCHEMBL14547937 0.91 LRRK2 (0.55) LRRK2PTK2JAK3BTKJAK2
SCHEMBL14547945 0.90 LRRK2 (0.56) LRRK2PTK2JAK3BTKJAK2
SCHEMBL14547785 0.83 LRRK2 (0.58) LRRK2PTK2JAK3BTKJAK2
SCHEMBL14547929 0.82 LRRK2 (0.63) LRRK2PTK2JAK3BTKJAK2
SCHEMBL14547717 0.82 LRRK2 (0.62) LRRK2PTK2JAK3BTKJAK2
SCHEMBL14547974 0.81 LRRK2 (0.55) LRRK2PTK2JAK3BTKJAK2
SCHEMBL14547777 0.80 PTK2 (0.65) LRRK2PTK2JAK3BTKJAK2
SCHEMBL14547851 0.79 LRRK2 (0.59) LRRK2PTK2JAK3BTKJAK2
SCHEMBL14287420 0.79 LRRK2 (0.72) LRRK2PTK2JAK3BTKJAK2

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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