SCHEMBL25992534

SCHEMBL25992534

CC(O)(c1ccc2ncc(-c3ccc(F)c(NC4CNCCC4F)n3)n2c1)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 9/20 0.42
▸ IRAK4 Q9NWZ3 14/20 0.41
▸ IRAK1 P51617 4/20 0.41
▸ NRAS P01111 4/20 0.41
▸ LCK P06239 2/20 0.39
▸ RET P07949 2/20 0.39
▸ PDGFRB P09619 2/20 0.39
▸ CDK7 P50613 2/20 0.39
▸ BLK P51451 2/20 0.39
▸ CCNH P51946 2/20 0.39
▸ SRPK1 Q96SB4 1/20 0.38
▸ EIF2AK4 Q9P2K8 1/20 0.36

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
SCHEMBL25988961 1.00 FLT3 (0.42) FLT3IRAK4IRAK1NRASLCK
SCHEMBL25988962 1.00 FLT3 (0.42) FLT3IRAK4IRAK1NRASLCK
SCHEMBL25339825 1.00 FLT3 (0.42) FLT3IRAK4IRAK1NRASLCK
SCHEMBL25989354 0.93 FLT3 (0.45) FLT3IRAK4IRAK1NRASLCK
SCHEMBL25998222 0.93 FLT3 (0.45) FLT3IRAK4IRAK1NRASLCK
SCHEMBL25989352 0.93 FLT3 (0.45) FLT3IRAK4IRAK1NRASLCK
SCHEMBL25993184 0.93 FLT3 (0.45) FLT3IRAK4IRAK1NRASLCK
SCHEMBL24231381 0.88 FLT3 (0.50) FLT3IRAK4IRAK1NRASCDK7
SCHEMBL24231327 0.88 FLT3 (0.50) FLT3IRAK4IRAK1NRASCDK7
SCHEMBL25988952 0.88 FLT3 (0.50) FLT3IRAK4IRAK1NRASCDK7

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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