SCHEMBL31334841

SCHEMBL31334841

CC(=O)N1CCC(Nc2ncc(F)c(-c3cccc(N4CCOCC4=O)n3)n2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 8/20 0.42
MAPK1 P28482 8/20 0.42
CCNA2 P20248 4/20 0.42
CCNA1 P78396 4/20 0.42
CDK1 P06493 4/20 0.42
CDK4 P11802 3/20 0.42
CCND1 P24385 3/20 0.42
GSK3B P49841 2/20 0.42
CCNB1 P14635 1/20 0.42
CCNE1 P24864 1/20 0.42
CDK5 Q00535 1/20 0.42
CDK5R1 Q15078 1/20 0.42
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
MAPK8 P45983 1/20 0.42
MAPK9 P45984 1/20 0.42
CSNK1A1 P48729 1/20 0.42
CSNK1D P48730 1/20 0.42
GSK3A P49840 1/20 0.42
CSNK1G2 P78368 1/20 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
SCHEMBL31334585 0.90 MAP4K1 (0.42) CDK2MAPK1CDK1CDK4CCND1
SCHEMBL31334500 0.87 MAP4K1 (0.41) CDK2MAPK1CCNA2CDK1CDK4
SCHEMBL31334480 0.87 MAPK1 (0.45) CDK2MAPK1CCNA2CCNA1CDK1
SCHEMBL31334176 0.86 MAP4K1 (0.40) CDK2MAPK1CCNA2CDK1CDK4
SCHEMBL31333754 0.86 CDK9 (0.42) CDK2MAPK1CDK1CDK4CCND1
SCHEMBL31334161 0.85 MAPK1 (0.46) CDK2MAPK1CCNA2CCNA1CDK1
SCHEMBL31333753 0.84 MAPK1 (0.46) CDK2MAPK1CDK1CDK4CCND1
SCHEMBL31334574 0.84 MAPK1 (0.46) CDK2MAPK1CDK1CDK4CCND1
SCHEMBL31333886 0.83 MAP4K1 (0.39) CDK2MAPK1CCNA2MAPK14MAP4K1
SCHEMBL31334530 0.83 MAP4K1 (0.39) CDK2MAPK1CCNA2MAPK14MAP4K1

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