SCHEMBL31334776

SCHEMBL31334776

NC(=O)C1CCCC(Nc2ncc(F)c(-c3cccc(N4CCOCC4=O)n3)n2)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 2/20 0.39
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
TYK2 P29597 1/20 0.37
JAK3 P52333 1/20 0.37
MAPK3 P27361 1/20 0.37
PTGS2 P35354 1/20 0.37
MAPK1 P28482 3/20 0.36
CDK2 P24941 4/20 0.36
CCNA2 P20248 3/20 0.36
CCNA1 P78396 3/20 0.36
SYK P43405 3/20 0.34
CDK1 P06493 1/20 0.34
CDK4 P11802 1/20 0.34
CCND1 P24385 1/20 0.34
PIK3CA P42336 1/20 0.34
CDK7 P50613 2/20 0.34
AURKA O14965 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
RAF1 P04049 1/20 0.34

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
SCHEMBL31333886 0.93 MAP4K1 (0.39) MAP4K1JAK2JAK1TYK2JAK3
SCHEMBL31334530 0.93 MAP4K1 (0.39) MAP4K1JAK2JAK1TYK2JAK3
SCHEMBL31334176 0.91 MAP4K1 (0.40) MAP4K1JAK2JAK1TYK2JAK3
SCHEMBL31334437 0.88 MAPK1 (0.43) MAP4K1PTGS2MAPK1RAF1BRAF
SCHEMBL31334057 0.87 RAF1 (0.40) JAK2JAK1TYK2JAK3MAPK3
SCHEMBL31334114 0.86 MAP4K1 (0.42) MAP4K1JAK2JAK1TYK2JAK3
SCHEMBL31334500 0.85 MAP4K1 (0.41) MAP4K1JAK2JAK1TYK2JAK3
SCHEMBL31333754 0.84 CDK9 (0.42) MAP4K1PTGS2MAPK1CDK2CDK1
SCHEMBL31334585 0.83 MAP4K1 (0.42) MAP4K1JAK2MAPK1CDK2CDK1
SCHEMBL31334841 0.83 CDK2 (0.42) MAP4K1MAPK3MAPK1CDK2CCNA2

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-4709720-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN Larkspur Biosciences, Inc. (US) 2026-03-18 EP disclosed
WO-2024233846-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES, INC. (US) 2024-11-14 WO disclosed