SCHEMBL27728186

SCHEMBL27728186

N#Cc1cnc2ccc(NCc3ccccc3)cc2c1NC1CCCC1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.61
MAP3K8 P41279 11/20 0.60
PRKCQ Q04759 1/20 0.48
DYRK1A Q13627 1/20 0.47
DYRK1B Q9Y463 1/20 0.47
EGFR P00533 2/20 0.46
ABL1 P00519 1/20 0.46
FLT1 P17948 1/20 0.46
KDR P35968 1/20 0.46
SYK P43405 1/20 0.46
MAP2K1 Q02750 2/20 0.43
IP6K1 Q92551 1/20 0.43
CHRM4 P08173 1/20 0.43
RAF1 P04049 1/20 0.42

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
SCHEMBL27707287 0.90 SRC (0.75) SRCMAP3K8DYRK1ADYRK1BEGFR
SCHEMBL4963365 0.89 SRC (0.77) SRCMAP3K8DYRK1ADYRK1BEGFR
SCHEMBL4960895 0.89 MAP3K8 (0.62) SRCMAP3K8DYRK1ADYRK1BEGFR
SCHEMBL27707397 0.88 SRC (0.55) SRCMAP3K8PRKCQDYRK1ADYRK1B
SCHEMBL27728200 0.86 MAP3K8 (0.61) SRCMAP3K8DYRK1ADYRK1BEGFR
SCHEMBL27707399 0.86 SRC (0.53) SRCMAP3K8DYRK1ADYRK1B
SCHEMBL4961427 0.85 MAP3K8 (0.63) SRCMAP3K8DYRK1ADYRK1BEGFR
SCHEMBL4963177 0.85 SRC (0.54) SRCMAP3K8DYRK1ADYRK1B
SCHEMBL27707426 0.84 MAP3K8 (0.65) SRCMAP3K8DYRK1ADYRK1BEGFR
SCHEMBL4960960 0.83 MAP3K8 (0.64) SRCMAP3K8DYRK1ADYRK1BEGFR

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
CN-101223143-A 3-cyanoquinoline inhibitors of TPL2 kinase and methods of making and using the same WYETH CORP (US) 2008-07-16 CN disclosed