SCHEMBL168061

SCHEMBL168061

COc1ccc2c(Nc3ccc(C#N)cc3F)c(N)cnc2c1OCc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.38
EGFR P00533 2/20 0.38
ERBB2 P04626 1/20 0.38
SLK Q9H2G2 2/20 0.38
STK10 O94804 1/20 0.38
FGFR1 P11362 2/20 0.36
FLT1 P17948 2/20 0.36
FLT4 P35916 2/20 0.36
KDR P35968 2/20 0.36
FGFR2 P21802 1/20 0.36
FGFR4 P22455 1/20 0.36
FGFR3 P22607 1/20 0.36
CSF1R P07333 2/20 0.35
KIT P10721 2/20 0.35
SLC6A9 P48067 1/20 0.35
GAK O14976 1/20 0.35
RIPK2 O43353 1/20 0.35
COQ8A Q8NI60 1/20 0.35
NLK Q9UBE8 1/20 0.35
CTSV O60911 1/20 0.35

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
SCHEMBL168460 0.87 ALDH1A1 (0.40) SLKSTK10SLC6A9CTSVCTSL
SCHEMBL168060 0.84 EGFR (0.52) SRCEGFRERBB2FGFR1FLT1
SCHEMBL248873 0.75 ATM (0.42)
SCHEMBL6386114 0.75 SRC (0.58) SRCEGFRERBB2FLT1KDR
SCHEMBL168459 0.72 EGFR (0.49) SRCEGFRERBB2FGFR1FLT1
SCHEMBL6387094 0.68 SRC (0.70) SRCEGFRERBB2
SCHEMBL5253010 0.68 SRC (0.50) SRC
SCHEMBL6186123 0.67 SRC (0.60) SRC
SCHEMBL1060980 0.67 MAOB (0.58) SLKSTK10SLC6A9ALDH1A1
SCHEMBL249906 0.66 MEN1 (0.46) CTSVCTSLALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609082-B1 IMIDAZO[4,5-C]QUINOLINES AS DNA-PK INHIBITORS MERCK PATENT GMBH (DE) 2015-02-18 EP disclosed
EP-2609082-A1 IMIDAZO[4,5-C]QUINOLINES AS DNA-PK INHIBITORS Merck Patent GmbH (DE) 2013-07-03 EP disclosed
WO-2012028233-A1 IMIDAZO[4,5-C]QUINOLINES AS DNA-PK INHIBITORS MERCK PATENT GMBH (DE) 2012-03-08 WO disclosed