SCHEMBL31333730

SCHEMBL31333730

COC(=O)[C@H]1CC[C@H](Nc2ncc(F)c(-c3cccc(C4(O)CCC4)n3)n2)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37
MAPK8 P45983 2/20 0.36
CDK2 P24941 6/20 0.35
CDK1 P06493 5/20 0.35
CDK4 P11802 4/20 0.35
CCND1 P24385 4/20 0.35
ABL1 P00519 2/20 0.35
JUN P05412 1/20 0.35
MAPK10 P53779 1/20 0.35
MCHR1 Q99705 2/20 0.34
CCNE1 P24864 2/20 0.34
CCNT1 O60563 2/20 0.34
CCNK O75909 1/20 0.34
CDK7 P50613 1/20 0.34
CDK9 P50750 1/20 0.34
CCNH P51946 1/20 0.34
MNAT1 P51948 1/20 0.34
CDK12 Q9NYV4 1/20 0.34
CCNB2 O95067 1/20 0.34

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
SCHEMBL31333506 0.90 ABL1 (0.36) CDK2CDK1CDK4CCND1ABL1
SCHEMBL31334134 0.89 MAPK3 (0.39) MAPK8CDK2CDK1CDK4CCND1
SCHEMBL31334019 0.83 MAPK1 (0.38) PDGFRBPDGFRAMAPK8CDK2CDK1
SCHEMBL31334522 0.76 CTSA (0.41) PDGFRBPDGFRACDK2CDK1MCHR1
SCHEMBL31333985 0.73 ADORA2A (0.38) CDK2CDK1ABL1MCHR1CCNE1
SCHEMBL31333524 0.73 SYK (0.42) PDGFRBPDGFRACDK2CDK1CDK4
SCHEMBL31334640 0.72 DYRK2 (0.38) MAPK8CDK2CDK1ABL1CCNE1
SCHEMBL31333789 0.72 DYRK2 (0.38) MAPK8CDK2CDK1ABL1CCNE1
SCHEMBL31333579 0.71 PDGFRB (0.41) PDGFRBPDGFRACDK2CDK1CDK4
SCHEMBL31333785 0.71 PIM1 (0.36) ABL1

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