SCHEMBL31334036

SCHEMBL31334036

CC(C)(C)OC(=O)[C@H]1CC[C@H](Nc2ncc(F)c(-c3cccc(N4CCCOC4=O)n3)n2)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 9/20 0.43
CDK1 P06493 5/20 0.36
CDK4 P11802 5/20 0.36
CCND1 P24385 5/20 0.36
CDK2 P24941 5/20 0.36
PIM1 P11309 3/20 0.35
DYRK2 Q92630 1/20 0.34
JUN P05412 1/20 0.33
MAPK10 P53779 1/20 0.33
IDH1 O75874 1/20 0.33
IDH2 P48735 1/20 0.33

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
SCHEMBL31333533 0.91 MAPK1 (0.43) MAPK1CDK1CDK4CCND1CDK2
SCHEMBL31333433 0.88 PIM1 (0.38) MAPK1CDK1CDK4CCND1CDK2
SCHEMBL31333753 0.88 MAPK1 (0.46) MAPK1CDK1CDK4CCND1CDK2
SCHEMBL31334239 0.88 MAPK1 (0.46) MAPK1CDK1CDK4CCND1CDK2
SCHEMBL31334777 0.88 PIM1 (0.39) MAPK1CDK1CDK4CCND1CDK2
SCHEMBL31334807 0.87 CDK1 (0.39) MAPK1CDK1CDK4CCND1CDK2
SCHEMBL31334433 0.86 MAPK8 (0.40) MAPK1CDK1CDK4CCND1CDK2
SCHEMBL31333645 0.84 PIM1 (0.44) MAPK1CDK1CDK4CCND1CDK2
SCHEMBL31334485 0.82 MAPK1 (0.43) MAPK1CDK1CDK4CCND1CDK2
SCHEMBL31334437 0.81 MAPK1 (0.43) MAPK1DYRK2

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