SCHEMBL24231809

SCHEMBL24231809

CC(C)(C)OC(=O)N1CCC(Nc2cccc(-c3cnc4ccc(C5(C)CC5)cn34)n2)C1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 8/20 0.52
▸ IRAK4 Q9NWZ3 11/20 0.47
▸ IDH1 O75874 1/20 0.44
▸ CCNT1 O60563 1/20 0.44
▸ USP30 Q70CQ3 2/20 0.44
▸ IRAK1 P51617 3/20 0.43
▸ LCK P06239 1/20 0.43
▸ RET P07949 1/20 0.43
▸ PDGFRB P09619 1/20 0.43
▸ CDK7 P50613 1/20 0.43
▸ BLK P51451 1/20 0.43
▸ CCNH P51946 1/20 0.43
▸ NRAS P01111 3/20 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
SCHEMBL24231490 0.90 FLT3 (0.50) FLT3IRAK4IDH1CCNT1USP30
SCHEMBL24574020 0.90 FLT3 (0.49) FLT3IRAK4IDH1CCNT1USP30
SCHEMBL24231687 0.88 CCNT1 (0.45) FLT3IRAK4IDH1CCNT1USP30
SCHEMBL24231686 0.86 IRAK4 (0.62) FLT3IRAK4CCNT1USP30IRAK1
SCHEMBL24231434 0.86 FLT3 (0.51) FLT3IRAK4IDH1CCNT1USP30
SCHEMBL24231547 0.85 FLT3 (0.46) FLT3IRAK4USP30IRAK1LCK
SCHEMBL19918240 0.85 FLT3 (0.51) FLT3IRAK4IDH1CCNT1USP30
SCHEMBL24574190 0.85 FLT3 (0.51) FLT3IRAK4IDH1CCNT1USP30
SCHEMBL24231865 0.84 IRAK4 (0.56) FLT3IRAK4CCNT1USP30
SCHEMBL24574159 0.84 FLT3 (0.51) FLT3IRAK4IDH1CCNT1USP30

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-2022026935-A1 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2022-02-03 — — WO disclosed
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