SCHEMBL31333657

SCHEMBL31333657

CC(C)(C)OC(=O)NCCCCCCCCCC(=O)N1CCC(Nc2ncc(Cl)c(-c3cccc(-c4ccccc4)c3)n2)CC1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 11/20 0.46
SIGMAR1 Q99720 2/20 0.46
MAPK8 P45983 6/20 0.46
MAPK9 P45984 6/20 0.46
JUN P05412 5/20 0.46
CDK2 P24941 5/20 0.46
MAPK10 P53779 4/20 0.45
SUV39H2 Q9H5I1 1/20 0.43

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
SCHEMBL31333366 0.96 MAPK1 (0.44) MAPK1SIGMAR1MAPK8MAPK9JUN
SCHEMBL31334928 0.94 SIGMAR1 (0.45) MAPK1SIGMAR1MAPK8MAPK9JUN
SCHEMBL31333436 0.91 MAPK1 (0.45) MAPK1SIGMAR1MAPK8MAPK9JUN
SCHEMBL31334146 0.85 MAPK8 (0.49) MAPK1MAPK8MAPK9JUNCDK2
SCHEMBL31334411 0.84 MAPK1 (0.51) MAPK1MAPK8MAPK9JUNCDK2
SCHEMBL31333217 0.84 MAPK8 (0.54) MAPK1MAPK8MAPK9JUNCDK2
SCHEMBL31333767 0.82 MAPK8 (0.50) MAPK1MAPK8MAPK9JUNCDK2
SCHEMBL31333690 0.81 CKS1B (0.51) MAPK1
SCHEMBL31334352 0.81 CKS1B (0.51) MAPK1
SCHEMBL31333971 0.80 MAPK1 (0.50) MAPK1MAPK8MAPK9JUNCDK2

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