SCHEMBL31000122

SCHEMBL31000122

CC(C)(C)OC(=O)N1CCC[C@@H](Nc2cncc(-c3cnc4ccc(C(C)(O)C(F)(F)F)cn34)n2)C1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EIF2AK4 Q9P2K8 13/20 0.43
▸ HDAC4 P56524 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ FLT3 P36888 2/20 0.39
▸ TRPV1 Q8NER1 1/20 0.39
▸ SYK P43405 1/20 0.38
▸ USP30 Q70CQ3 1/20 0.36
▸ FGFR3 P22607 1/20 0.36
▸ KDR P35968 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
SCHEMBL24977595 0.89 HDAC4 (0.38) EIF2AK4HDAC4HDAC6FLT3TRPV1
SCHEMBL24977598 0.89 HDAC4 (0.38) EIF2AK4HDAC4HDAC6FLT3TRPV1
SCHEMBL376183 0.88 EIF2AK4 (0.49) EIF2AK4HDAC4HDAC6FLT3SYK
SCHEMBL31000078 0.87 EIF2AK4 (0.46) EIF2AK4HDAC4HDAC6TRPV1
SCHEMBL376423 0.87 FLT3 (0.53) EIF2AK4FLT3
SCHEMBL376422 0.87 FLT3 (0.53) EIF2AK4FLT3
SCHEMBL25998064 0.87 EIF2AK4 (0.44) EIF2AK4HDAC4HDAC6FLT3TRPV1
SCHEMBL12552862 0.86 IRAK4 (0.47) EIF2AK4HDAC4HDAC6FLT3USP30
SCHEMBL24231691 0.85 SYK (0.43) EIF2AK4HDAC4HDAC6FLT3SYK
SCHEMBL376257 0.84 IRAK4 (0.45) HDAC4HDAC6FLT3USP30

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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