SCHEMBL14411716

SCHEMBL14411716

Cn1c(Nc2ccccc2)ncc(-c2ccc(Cc3ccnc4[nH]nc(-c5ccc(C(=O)N6CCOCC6)cc5)c34)c(F)c2)c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.45
NTRK1 P04629 8/20 0.40
BDKRB1 P46663 2/20 0.40
JAK2 O60674 2/20 0.40
EGFR P00533 1/20 0.40
HGF P14210 1/20 0.40
FLT1 P17948 1/20 0.40
FGFR2 P21802 1/20 0.40
RPS6KB1 P23443 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
TEK Q02763 1/20 0.40
MST1R Q04912 1/20 0.40
BTK Q06187 1/20 0.40
LRRK2 Q5S007 2/20 0.38
TGFBR1 P36897 1/20 0.38
CSF1R P07333 1/20 0.37
RIPK1 Q13546 1/20 0.37
JAK1 P23458 1/20 0.36
TYK2 P29597 1/20 0.36

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
SCHEMBL3104694 0.87 MET (0.55) METJAK2EGFRHGFFLT1
SCHEMBL2285261 0.73 MET (0.58) METJAK2EGFRHGFFLT1
SCHEMBL3101384 0.73 MET (0.53) METJAK2EGFRHGFFLT1
SCHEMBL3107124 0.72 MET (0.63) METJAK2EGFRHGFFLT1
SCHEMBL3110874 0.72 LRRK2 (0.41) METJAK2EGFRHGFFLT1
SCHEMBL2281471 0.69 MET (0.50) METJAK2EGFRHGFFLT1
SCHEMBL3111401 0.68 MET (0.66) METJAK2EGFRHGFFLT1
SCHEMBL2288757 0.67 MET (0.58) METJAK2EGFRHGFFLT1
SCHEMBL13116045 0.66 MET (0.58) METJAK2EGFRHGFFLT1
SCHEMBL12409582 0.66 MET (0.45) METBDKRB1JAK2EGFRHGF

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-2007103308-A2 HETEROBICYCLIC PYRAZOLE COMPOUNDS AND METHODS OF USE ARRAY BIOPHARMA INC. (US) 2007-09-13 WO disclosed