SCHEMBL31334969

SCHEMBL31334969

CC(=O)N[C@H]1CC[C@H](Nc2ncc(F)c(-c3ccnc(N4CCOC4=O)c3)n2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 9/20 0.42
CDK2 P24941 4/20 0.40
MAPK8 P45983 3/20 0.40
MAPK9 P45984 2/20 0.40
MAPK10 P53779 2/20 0.40
CCNE1 P24864 2/20 0.40
CYP2C9 P11712 1/20 0.40
MAPK14 Q16539 1/20 0.40
CCNA2 P20248 1/20 0.40
MAPK3 P27361 1/20 0.40
JAK2 O60674 1/20 0.39
CDK1 P06493 2/20 0.39
CCNB2 O95067 1/20 0.39
CCNE2 O96020 1/20 0.39
CCNB1 P14635 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39
CCNB3 Q8WWL7 1/20 0.39
PSEN1 P49768 3/20 0.38
PSEN2 P49810 3/20 0.38

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
SCHEMBL31334974 0.95 MAPK1 (0.41) MAPK1CDK2MAPK8MAPK9MAPK10
SCHEMBL31333818 0.89 RAF1 (0.43) MAPK1CDK2MAPK8MAPK9MAPK10
SCHEMBL31333578 0.89 MAPK1 (0.41) MAPK1CDK2CCNE1CCNA2MAPK3
SCHEMBL31334131 0.89 MAPK1 (0.48) MAPK1CDK2CCNE1CCNA2MAPK3
SCHEMBL31334637 0.89 MAPK1 (0.42) MAPK1CDK2CCNE1CCNA2MAPK3
SCHEMBL31334772 0.88 MAP4K1 (0.40) MAPK1CDK2MAPK10CCNE1CCNA2
SCHEMBL31334337 0.88 CDK7 (0.42) MAPK1CDK2MAPK8MAPK10CCNE1
SCHEMBL31334173 0.87 MAPK1 (0.42) MAPK1CDK2MAPK8MAPK9MAPK10
SCHEMBL31334761 0.86 MAPK8 (0.43) MAPK1CDK2MAPK8MAPK9MAPK10
SCHEMBL31333274 0.85 MAPK8 (0.43) MAPK1CDK2MAPK8MAPK9MAPK10

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