SCHEMBL31334003

SCHEMBL31334003

CC(C)(C)OC(=O)[C@H]1CC[C@H](Nc2ncc(F)c(-c3ccnc(N4CCOCC4=O)c3)n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 11/20 0.49
RAF1 P04049 2/20 0.42
BRAF P15056 2/20 0.42
CDK2 P24941 3/20 0.38
CCNA2 P20248 1/20 0.38
MAPK3 P27361 1/20 0.38
DYRK2 Q92630 2/20 0.38
CCNE1 P24864 2/20 0.37
MAPK8 P45983 1/20 0.37
MAPK9 P45984 1/20 0.37
MAPK10 P53779 1/20 0.37
CDK4 P11802 2/20 0.36
CCND1 P24385 2/20 0.36
CCND3 P30281 2/20 0.36
CDK6 Q00534 2/20 0.36
JAK2 O60674 1/20 0.36
CCNB2 O95067 1/20 0.36
CCNE2 O96020 1/20 0.36
CDK1 P06493 1/20 0.36
CCNB1 P14635 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
SCHEMBL31334064 0.92 MAPK1 (0.46) MAPK1RAF1BRAFCDK2CCNA2
SCHEMBL31334133 0.91 MAPK1 (0.49) MAPK1RAF1BRAFCDK2CCNA2
SCHEMBL31333463 0.88 RAF1 (0.42) MAPK1RAF1BRAFCDK2CCNA2
SCHEMBL31333370 0.88 MAPK1 (0.49) MAPK1CDK2CCNA2MAPK3DYRK2
SCHEMBL31333753 0.88 MAPK1 (0.46) MAPK1RAF1BRAFCDK2CCNE1
SCHEMBL31334239 0.88 MAPK1 (0.46) MAPK1RAF1BRAFCDK2CCNE1
SCHEMBL31333554 0.88 RAF1 (0.42) MAPK1RAF1BRAFCDK2CCNA2
SCHEMBL31333818 0.86 RAF1 (0.43) MAPK1RAF1BRAFCDK2CCNA2
SCHEMBL31334480 0.84 MAPK1 (0.45) MAPK1RAF1BRAFCDK2CCNA2
SCHEMBL31333693 0.84 CCNK (0.41) MAPK1RAF1BRAFCDK2CCNA2

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