SCHEMBL31000146

SCHEMBL31000146

COc1cc2ncc(-c3nc(N[C@H]4CNCC[C@@H]4F)ncc3F)n2nc1N1CCS(=O)(=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 7/20 0.38
▸ NRAS P01111 6/20 0.38
▸ CDK2 P24941 4/20 0.37
▸ IGF1R P08069 1/20 0.37
▸ CDK7 P50613 4/20 0.36
▸ CCNH P51946 4/20 0.36
▸ CCNT1 O60563 3/20 0.36
▸ CCNK O75909 3/20 0.36
▸ CCNE1 P24864 3/20 0.36
▸ CDK9 P50750 3/20 0.36
▸ CDK12 Q9NYV4 3/20 0.36
▸ MNAT1 P51948 2/20 0.36
▸ ALK Q9UM73 5/20 0.34
▸ IRAK1 P51617 3/20 0.32
▸ PDGFRB P09619 2/20 0.32
▸ IRAK4 Q9NWZ3 2/20 0.32
▸ LCK P06239 1/20 0.32
▸ RET P07949 1/20 0.32
▸ TTK P33981 1/20 0.32
▸ BCL6 P41182 1/20 0.32

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
SCHEMBL31000172 0.85 FLT3 (0.37) FLT3NRASCDK2IGF1RCDK7
SCHEMBL31000198 0.83 CDK7 (0.41) FLT3NRASCDK2IGF1RCDK7
SCHEMBL31000192 0.83 CDK4 (0.42) CDK2IGF1RALK
SCHEMBL31000306 0.83 GAA (0.40) FLT3NRASCDK2IGF1RCDK7
SCHEMBL31000215 0.81 FLT3 (0.39) FLT3NRASCDK2IGF1RCDK7
SCHEMBL31000224 0.81 FLT3 (0.39) FLT3NRASCDK2IGF1RCDK7
SCHEMBL31000232 0.81 FLT3 (0.39) FLT3NRASCDK2IGF1RCDK7
SCHEMBL31000190 0.80 FLT3 (0.39) FLT3NRASCDK2IGF1RCDK7
SCHEMBL31639195 0.79 FLT3 (0.46) FLT3NRASCDK7CCNHIRAK1
SCHEMBL31000079 0.78 PIM1 (0.35) CDK2IGF1RCCNT1CDK9TTK

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
EP-4658659-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF Children's Hospital Medical Center (US) 2025-12-10 — — EP disclosed
WO-2024163764-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2024-08-08 — — WO disclosed
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