SCHEMBL24574169

SCHEMBL24574169

CC(C)(C)OC(=O)N1CCC(Nc2cccc(-c3cnc4cnccn34)n2)C1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 3/20 0.47
▸ FLT3 P36888 6/20 0.47
▸ CCNT1 O60563 1/20 0.45
▸ IRAK4 Q9NWZ3 6/20 0.44
▸ CDK2 P24941 2/20 0.44
▸ JUN P05412 1/20 0.44
▸ MAPK8 P45983 1/20 0.44
▸ MAPK9 P45984 1/20 0.44
▸ MAPK10 P53779 1/20 0.44
▸ SYK P43405 1/20 0.43
▸ IDH1 O75874 1/20 0.43
▸ CCNA2 P20248 1/20 0.41

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
SCHEMBL24231865 0.90 IRAK4 (0.56) USP30FLT3CCNT1IRAK4CDK2
SCHEMBL24231869 0.87 FLT3 (0.58) USP30FLT3CCNT1IRAK4IDH1
SCHEMBL24231604 0.87 FLT3 (0.58) USP30FLT3CCNT1IRAK4IDH1
SCHEMBL24574190 0.86 FLT3 (0.51) USP30FLT3CCNT1IRAK4SYK
SCHEMBL24232046 0.86 FLT3 (0.47) USP30FLT3CCNT1IRAK4SYK
SCHEMBL24574511 0.86 FLT3 (0.53) USP30FLT3CCNT1IRAK4IDH1
SCHEMBL24574159 0.86 FLT3 (0.51) USP30FLT3CCNT1IRAK4SYK
SCHEMBL24574154 0.86 FLT3 (0.51) USP30FLT3CCNT1IRAK4SYK
SCHEMBL24231463 0.85 IRAK4 (0.48) USP30FLT3CCNT1IRAK4IDH1
SCHEMBL24542493 0.85 USP30 (0.47) USP30FLT3CCNT1IRAK4SYK

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-2022140647-A1 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2022-06-30 — — WO disclosed
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