SCHEMBL679247

SCHEMBL679247

Cn1ncc2cc(Oc3ccc([N+](=O)[O-])cc3F)c(-c3cccnc3)cc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 4/20 0.47
CYP11B2 P19099 4/20 0.47
CYP19A1 P11511 3/20 0.47
MET P08581 2/20 0.40
PLK4 O00444 1/20 0.40
NTRK1 P04629 1/20 0.40
RET P07949 1/20 0.40
AXL P30530 1/20 0.40
KDR P35968 1/20 0.40
FLT3 P36888 1/20 0.40
MST1R Q04912 1/20 0.40
DDR1 Q08345 1/20 0.40
MERTK Q12866 1/20 0.40
CAMK4 Q16566 1/20 0.40
DDR2 Q16832 1/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
HSPB1 P04792 3/20 0.40
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL23081442 0.85 CCNT1 (0.42) METPLK4NTRK1RETAXL
SCHEMBL680085 0.84 S1PR4 (0.44) CYP11B1CYP11B2CYP19A1METPLK4
SCHEMBL680355 0.84 PLK4 (0.53) METPLK4NTRK1RETAXL
SCHEMBL680022 0.84 CYP11B1 (0.43) CYP11B1CYP11B2CYP19A1METPLK4
SCHEMBL680514 0.83 PLK4 (0.41) METPLK4NTRK1RETAXL
SCHEMBL680923 0.81 CYP11B1 (0.40) CYP11B1CYP11B2CYP19A1METHSPB1
SCHEMBL29487166 0.80 HSPB1 (0.44) METPLK4NTRK1RETAXL
SCHEMBL679255 0.80 HSPB1 (0.44) METPLK4NTRK1RETAXL
SCHEMBL679110 0.80 SERPINE1 (0.43) METPLK4NTRK1RETAXL
SCHEMBL680501 0.80 SCN9A (0.43) METPLK4NTRK1RETAXL

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
EP-2310382-B1 AMIDOPHENOXYINDAZOLES USEFUL AS INHIBITORS OF C-MET LILLY CO ELI (US) 2012-02-22 EP disclosed