SCHEMBL680202

SCHEMBL680202

COc1ncc(-c2cc3[nH]ncc3cc2Oc2ccc(N)cc2F)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.46
BTK Q06187 2/20 0.44
FYN P06241 2/20 0.44
SRC P12931 1/20 0.44
TEC P42680 1/20 0.44
ITK Q08881 1/20 0.44
MAPK14 Q16539 1/20 0.40
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
ROCK1 Q13464 2/20 0.39
PKM P14618 1/20 0.39
HTT P42858 1/20 0.39
ROCK2 O75116 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
HIF1A Q16665 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
SCHEMBL680692 0.85 TLR8 (0.41) TLR8BTKFYNSRCTEC
SCHEMBL680227 0.85 KDM4E (0.46) TLR8BTKFYNSRCTEC
SCHEMBL680323 0.84 TLR8 (0.44) TLR8BTKFYNSRCTEC
SCHEMBL679260 0.83 TLR8 (0.59) TLR8BTKFYNSRCTEC
SCHEMBL680260 0.82 TLR8 (0.46) TLR8BTKFYNSRCTEC
SCHEMBL680251 0.80 FGFR1 (0.45) TLR8BTKFYNSRCTEC
SCHEMBL680953 0.76 ROCK2 (0.44) TLR8BTKFYNSRCTEC
SCHEMBL680325 0.76 KDM4E (0.38) TLR8BTKFYNSRCTEC
SCHEMBL8325182 0.71 KDM4E (0.58) MAPK14KDM4EMEN1MAPTKMT2A
SCHEMBL2876364 0.71 ROCK1 (0.58) MAPK14KDM4EMEN1MAPTKMT2A

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