SCHEMBL20182264

SCHEMBL20182264

N=N/C(=C\Nc1ccccc1F)Cn1cc(-c2cnco2)c2c(N)ncnc21

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 5/20 0.35
LCK P06239 2/20 0.33
TEK Q02763 1/20 0.33
EIF2AK3 Q9NZJ5 4/20 0.33
RET P07949 1/20 0.33
FLT3 P36888 7/20 0.32
LRRK2 Q5S007 1/20 0.30

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
SCHEMBL20182198 0.80 SRC (0.34) SRCLCKTEKEIF2AK3RET
SCHEMBL20182196 0.79 EIF2AK3 (0.37) SRCLCKTEKEIF2AK3FLT3
SCHEMBL20173329 0.79 EIF2AK3 (0.38) SRCLCKTEKEIF2AK3
SCHEMBL20181911 0.78 EIF2AK3 (0.37) SRCLCKTEKEIF2AK3
SCHEMBL20182281 0.75 FLT3 (0.39) SRCEIF2AK3FLT3
SCHEMBL20182190 0.72 CFTR (0.35)
SCHEMBL20162971 0.70 CFTR (0.42) SRCLCKRET
SCHEMBL20182347 0.68 LRRK2 (0.37) SRCLCKTEKEIF2AK3FLT3
SCHEMBL20182360 0.68 FYN (0.35) SRCLCKTEKFLT3LRRK2
SCHEMBL20182203 0.67 CFTR (0.37) LCKTEKLRRK2

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-2018094137-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUNDATION THERAPEUTICS INC. (US) 2018-05-24 WO disclosed