SCHEMBL31334057

SCHEMBL31334057

NC(=O)C1CCCC(Nc2ncc(F)c(-c3ccnc(N4CCOCC4=O)c3)n2)C1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 2/20 0.40
BRAF P15056 2/20 0.40
MAPK1 P28482 6/20 0.39
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
MAPK3 P27361 1/20 0.38
MAPK10 P53779 7/20 0.37
JAK2 O60674 2/20 0.36
JAK1 P23458 1/20 0.36
TYK2 P29597 1/20 0.36
JAK3 P52333 1/20 0.36
PTGS2 P35354 1/20 0.36
PRKD1 Q15139 1/20 0.35
PIK3CA P42336 1/20 0.35

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
SCHEMBL31333258 0.93 RAF1 (0.41) RAF1BRAFMAPK1CCNA2CDK2
SCHEMBL31333554 0.91 RAF1 (0.42) RAF1BRAFMAPK1CCNA2CDK2
SCHEMBL31334064 0.88 MAPK1 (0.46) RAF1BRAFMAPK1CCNA2CDK2
SCHEMBL31334114 0.88 MAP4K1 (0.42) MAPK1CCNA2CDK2MAPK3JAK2
SCHEMBL31334776 0.87 MAP4K1 (0.39) RAF1BRAFMAPK1CCNA2CDK2
SCHEMBL31333463 0.85 RAF1 (0.42) RAF1BRAFMAPK1CCNA2CDK2
SCHEMBL31333693 0.84 CCNK (0.41) RAF1BRAFMAPK1CCNA2CDK2
SCHEMBL31333818 0.83 RAF1 (0.43) RAF1BRAFMAPK1CCNA2CDK2
SCHEMBL31334480 0.83 MAPK1 (0.45) RAF1BRAFMAPK1CCNA2CDK2
SCHEMBL31333975 0.81 PRKD1 (0.40) MAPK1CCNA2CDK2MAPK3MAPK10

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