SCHEMBL25335157

SCHEMBL25335157

CC(O)(c1ccc2ncc(-c3ccc(F)c(N[C@H]4CN(C(=O)O)CC[C@@H]4F)n3)n2c1)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EIF2AK4 Q9P2K8 16/20 0.42
▸ FLT3 P36888 3/20 0.37
▸ PDK1 Q15118 1/20 0.34
▸ PDK2 Q15119 1/20 0.34

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
SCHEMBL25338902 0.91 EIF2AK4 (0.43) EIF2AK4FLT3
SCHEMBL25339825 0.84 FLT3 (0.42) EIF2AK4FLT3
SCHEMBL25992534 0.84 FLT3 (0.42) EIF2AK4FLT3
SCHEMBL25988961 0.84 FLT3 (0.42) EIF2AK4FLT3
SCHEMBL25988962 0.84 FLT3 (0.42) EIF2AK4FLT3
SCHEMBL25338907 0.84 EIF2AK4 (0.39) EIF2AK4FLT3
SCHEMBL25989352 0.83 FLT3 (0.45) EIF2AK4FLT3
SCHEMBL25989354 0.83 FLT3 (0.45) EIF2AK4FLT3
SCHEMBL25993184 0.83 FLT3 (0.45) EIF2AK4FLT3
SCHEMBL25998222 0.83 FLT3 (0.45) EIF2AK4FLT3

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
WO-2023150601-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2023-08-10 — — WO disclosed
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