SCHEMBL29631656

SCHEMBL29631656

Nc1ccc(-c2cc(-c3cnn(C4CCOCC4)c3)cnc2N)c(F)c1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 13/20 0.59
▸ AXL P30530 1/20 0.53
▸ MERTK Q12866 1/20 0.53
▸ JAK2 O60674 5/20 0.53
▸ JAK1 P23458 1/20 0.53
▸ JAK3 P52333 1/20 0.53
▸ GRK2 P25098 4/20 0.52
▸ GRK5 P34947 4/20 0.52
▸ FLT3 P36888 2/20 0.52
▸ ABL1 P00519 1/20 0.49
▸ RET P07949 1/20 0.49
▸ FGFR1 P11362 1/20 0.49
▸ FLT1 P17948 1/20 0.49
▸ EPHA2 P29317 1/20 0.49
▸ MST1R Q04912 1/20 0.49
▸ KCNH2 Q12809 1/20 0.46

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
SCHEMBL21776583 1.00 MET (0.59) METAXLMERTKJAK2JAK1
SCHEMBL28343404 0.88 MET (0.59) METAXLMERTKJAK2JAK1
SCHEMBL24304281 0.87 MET (0.46) METAXLMERTKJAK2JAK1
SCHEMBL30387845 0.87 MET (0.61) METAXLMERTKGRK2GRK5
SCHEMBL21776610 0.87 MET (0.61) METAXLMERTKGRK2GRK5
SCHEMBL29631682 0.86 MET (0.64) METAXLMERTKJAK2JAK1
SCHEMBL28346361 0.86 MET (0.64) METAXLMERTKJAK2JAK1
SCHEMBL29631680 0.85 MET (0.59) METAXLMERTKJAK2JAK1
SCHEMBL28343405 0.85 MET (0.59) METAXLMERTKJAK2JAK1
SCHEMBL30388140 0.83 MET (0.51) METFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113195471-B Polysubstituted pyridone derivative and application thereof in medicine 苏州浦合医药科技有限公司 2023-05-02 — — CN disclosed
CN-110520416-B Polysubstituted pyridone derivative, preparation method and medical application thereof 北京越之康泰生物医药科技有限公司 2022-06-03 — — CN disclosed
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