SCHEMBL31334176

SCHEMBL31334176

NC(=O)[C@H]1CC[C@H](Nc2ncc(F)c(-c3cccc(N4CCOCC4=O)n3)n2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 2/20 0.40
MAPK1 P28482 5/20 0.39
CDK2 P24941 5/20 0.39
CDK1 P06493 3/20 0.39
CDK4 P11802 3/20 0.39
CCND1 P24385 3/20 0.39
CCNE1 P24864 1/20 0.39
MAPK8 P45983 1/20 0.39
MAPK9 P45984 1/20 0.39
MAPK10 P53779 1/20 0.39
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38
JAK3 P52333 1/20 0.38
MAPK3 P27361 3/20 0.37
MAPK6 Q16659 1/20 0.37
SYK P43405 1/20 0.36
PTGS2 P35354 1/20 0.36
MAPK14 Q16539 1/20 0.36
CCNA2 P20248 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
SCHEMBL31334500 0.92 MAP4K1 (0.41) MAP4K1MAPK1CDK2CDK1CDK4
SCHEMBL31334776 0.91 MAP4K1 (0.39) MAP4K1MAPK1CDK2CDK1CDK4
SCHEMBL31333754 0.90 CDK9 (0.42) MAP4K1MAPK1CDK2CDK1CDK4
SCHEMBL31334585 0.88 MAP4K1 (0.42) MAP4K1MAPK1CDK2CDK1CDK4
SCHEMBL31334239 0.87 MAPK1 (0.46) MAP4K1MAPK1CDK2CDK1CDK4
SCHEMBL31333753 0.87 MAPK1 (0.46) MAP4K1MAPK1CDK2CDK1CDK4
SCHEMBL31334634 0.87 CDK2 (0.39) MAPK1CDK2CDK1CDK4CCND1
SCHEMBL31333554 0.87 RAF1 (0.42) MAPK1CDK2CDK1CCNE1MAPK8
SCHEMBL31334777 0.87 PIM1 (0.39) MAP4K1MAPK1CDK2CDK1CDK4
SCHEMBL31334841 0.86 CDK2 (0.42) MAP4K1MAPK1CDK2CDK1CDK4

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