SCHEMBL14547733

SCHEMBL14547733

FC(F)(F)CNc1nc(Nc2ccc(CCN3CCCC3)cc2)nc2[nH]ccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 3/20 0.59
▸ KDR P35968 6/20 0.54
▸ IGF1R P08069 5/20 0.54
▸ RET P07949 4/20 0.54
▸ JAK3 P52333 4/20 0.54
▸ PTK2 Q05397 4/20 0.54
▸ JAK2 O60674 3/20 0.54
▸ PAK4 O96013 3/20 0.54
▸ BTK Q06187 3/20 0.54
▸ AURKA O14965 2/20 0.54
▸ DAPK3 O43293 2/20 0.54
▸ CSF1R P07333 2/20 0.54
▸ LTK P29376 2/20 0.54
▸ MAP2K2 P36507 2/20 0.54
▸ MAPK8 P45983 2/20 0.54
▸ MAPK9 P45984 2/20 0.54
▸ CLK2 P49760 2/20 0.54
▸ RPS6KA3 P51812 2/20 0.54
▸ CDK5 Q00535 2/20 0.54
▸ MAP2K1 Q02750 2/20 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
SCHEMBL14547860 0.92 LRRK2 (0.56) LRRK2KDRIGF1RRETJAK3
SCHEMBL14547735 0.83 LRRK2 (0.58) LRRK2KDRIGF1RRETJAK3
SCHEMBL14547969 0.83 PTK2 (0.75) LRRK2KDRIGF1RRETJAK3
SCHEMBL14547960 0.82 LRRK2 (0.58) LRRK2KDRIGF1RRETJAK3
SCHEMBL14547864 0.81 LRRK2 (0.62) LRRK2KDRIGF1RRETJAK3
SCHEMBL14547958 0.80 LRRK2 (0.72) LRRK2KDRIGF1RRETJAK3
SCHEMBL14287420 0.80 LRRK2 (0.72) LRRK2KDRIGF1RRETJAK3
SCHEMBL14287419 0.79 LRRK2 (0.71) LRRK2KDRIGF1RRETJAK3
SCHEMBL14547935 0.79 LRRK2 (0.74) LRRK2KDRIGF1RRETJAK3
SCHEMBL14547919 0.79 LRRK2 (0.70) LRRK2KDRIGF1RRETJAK3

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
Send feedback