SCHEMBL31334568

SCHEMBL31334568

CC(=O)N[C@H]1CC[C@H](Nc2ncc(F)c(-c3cccc(-n4cc(C(F)(F)F)ccc4=O)c3)n2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
MAPK8 P45983 5/20 0.39
MAPK1 P28482 5/20 0.39
MAPK9 P45984 4/20 0.39
MAPK10 P53779 4/20 0.39
CDK2 P24941 2/20 0.38
CCNB2 O95067 1/20 0.38
CCNE2 O96020 1/20 0.38
CDK1 P06493 1/20 0.38
CCNB1 P14635 1/20 0.38
CCNE1 P24864 1/20 0.38
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38
CCNB3 Q8WWL7 1/20 0.38
MCHR1 Q99705 2/20 0.37
CCNA2 P20248 1/20 0.37
MAPK3 P27361 1/20 0.37
MAPK14 Q16539 1/20 0.37

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
SCHEMBL31333236 0.90 SYK (0.38) MAPK1CDK2CCNB2CCNE2CDK1
SCHEMBL31333692 0.90 MAPK8 (0.40) MAPK8MAPK1MAPK9MAPK10CDK2
SCHEMBL31334023 0.89 MAPK1 (0.39) MAPK8MAPK1MAPK9MAPK10CDK2
SCHEMBL31334506 0.89 MAPK3 (0.40) KDM1AMAOAMAOBMAPK1CDK2
SCHEMBL31334364 0.87 SYK (0.44) MAPK8MAPK1MAPK9MAPK10CDK2
SCHEMBL31333858 0.84 MAPK3 (0.41) MAPK1CDK2CCNA2MAPK3PDE4A
SCHEMBL31333877 0.84 CDK2 (0.40) KDM1AMAOAMAOBMAPK1CDK2
SCHEMBL31334697 0.82 MAPK1 (0.41) MAPK1CDK2CCNA2MAPK3CDK4
SCHEMBL31334631 0.80 SYK (0.43) MAPK8MAPK9MAPK10CDK2CCNB2
SCHEMBL31333452 0.79 MAPK8 (0.50) MAPK8MAPK1MAPK9MAPK10CDK2

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