SCHEMBL27369260

SCHEMBL27369260

CC(O)(c1cn2c(-c3cccc(NC4CNCC4F)n3)cnc2cn1)C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 16/20 0.48
IRAK4 Q9NWZ3 9/20 0.48
NRAS P01111 5/20 0.48
IRAK1 P51617 3/20 0.43
LCK P06239 2/20 0.42
RET P07949 2/20 0.42
PDGFRB P09619 2/20 0.42
CDK7 P50613 2/20 0.42
BLK P51451 2/20 0.42
CCNH P51946 2/20 0.42
SRPK1 Q96SB4 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
SCHEMBL24574348 1.00 FLT3 (0.48) FLT3IRAK4NRASIRAK1LCK
SCHEMBL24574380 1.00 FLT3 (0.48) FLT3IRAK4NRASIRAK1LCK
SCHEMBL29748633 1.00 FLT3 (0.48) FLT3IRAK4NRASIRAK1LCK
SCHEMBL24574000 0.92 IRAK4 (0.49) FLT3IRAK4NRASIRAK1LCK
SCHEMBL27362525 0.92 IRAK4 (0.49) FLT3IRAK4NRASIRAK1LCK
SCHEMBL31068078 0.92 IRAK4 (0.49) FLT3IRAK4NRASIRAK1LCK
SCHEMBL24573964 0.92 FLT3 (0.50) FLT3IRAK4NRASIRAK1LCK
SCHEMBL31068059 0.92 FLT3 (0.50) FLT3IRAK4NRASIRAK1LCK
SCHEMBL27368893 0.92 FLT3 (0.50) FLT3IRAK4NRASIRAK1LCK
SCHEMBL24573924 0.90 FLT3 (0.52) FLT3IRAK4NRASIRAK1LCK

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-2023250431-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2023-12-28 WO disclosed