SCHEMBL31334149

SCHEMBL31334149

NC(=O)[C@H]1CC[C@H](Nc2ncc(F)c(-c3cccc(C4COC4)c3)n2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.40
MAPK3 P27361 3/20 0.39
CDK2 P24941 2/20 0.39
CCNA2 P20248 1/20 0.39
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
BRAF P15056 5/20 0.38
RAF1 P04049 3/20 0.38
ADORA1 P30542 3/20 0.38
PDE4A P27815 2/20 0.37
PDE4B Q07343 2/20 0.37
PDE4C Q08493 2/20 0.37
PDE4D Q08499 2/20 0.37
MAPK6 Q16659 1/20 0.37
KDM1A O60341 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
ADORA2A P29274 2/20 0.36
CCNB2 O95067 1/20 0.36
CCNE2 O96020 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
SCHEMBL31333197 0.92 MAPK3 (0.41) MAPK1MAPK3CDK2CCNA2CSNK2A2
SCHEMBL31334468 0.92 CSNK2A2 (0.41) MAPK1MAPK3CDK2CCNA2CSNK2A2
SCHEMBL31334502 0.90 MAPK3 (0.39) MAPK1MAPK3CDK2CCNA2BRAF
SCHEMBL31334579 0.89 MAPK1 (0.42) MAPK1MAPK3CDK2CCNA2CSNK2A2
SCHEMBL31334493 0.87 MAPK8 (0.43) MAPK1MAPK3CDK2CCNA2CSNK2A2
SCHEMBL31333834 0.85 ADORA1 (0.46) MAPK1MAPK3CDK2CSNK2A2CSNK2B
SCHEMBL31334731 0.84 MAPK3 (0.41) MAPK1MAPK3CDK2CCNA2CSNK2A2
SCHEMBL31335048 0.84 MAPK3 (0.41) MAPK1MAPK3CDK2CCNA2CSNK2A2
SCHEMBL31335060 0.84 MAPK1 (0.45) MAPK1MAPK3CDK2CCNA2CCNB2
SCHEMBL31333233 0.84 NPC1 (0.43) MAPK1MAPK3CDK2CCNA2CSNK2A2

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