SCHEMBL31334783

SCHEMBL31334783

CC(=O)N[C@H]1CC[C@H](Nc2ncc(F)c(-c3cccc(C4CC4)c3)n2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 3/20 0.45
MAPK9 P45984 2/20 0.45
MAPK10 P53779 2/20 0.45
MAPK14 Q16539 1/20 0.44
MCHR1 Q99705 5/20 0.43
ADRA2A P08913 2/20 0.41
ADRA1A P35348 2/20 0.41
HRH1 P35367 2/20 0.41
HTR2B P41595 2/20 0.41
CCNE1 P24864 2/20 0.41
CDK2 P24941 2/20 0.41
ADORA1 P30542 2/20 0.41
CCNB2 O95067 1/20 0.41
CCNE2 O96020 1/20 0.41
CDK1 P06493 1/20 0.41
CCNB1 P14635 1/20 0.41
CDK5 Q00535 1/20 0.41
CDK5R1 Q15078 1/20 0.41
CCNB3 Q8WWL7 1/20 0.41
CSNK2A2 P19784 1/20 0.41

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
SCHEMBL31334493 0.92 MAPK8 (0.43) MAPK8MAPK9MAPK10MAPK14MCHR1
SCHEMBL31333452 0.89 MAPK8 (0.50) MAPK8MAPK9MAPK10MAPK14MCHR1
SCHEMBL31334825 0.88 JAK3 (0.48) MAPK8MAPK9MAPK10MAPK14MCHR1
SCHEMBL31333412 0.88 MAPK8 (0.43) MAPK8MAPK9MAPK10MAPK14MCHR1
SCHEMBL31333445 0.87 MAPK1 (0.47) MCHR1ADRA2AADRA1AHRH1HTR2B
SCHEMBL31333233 0.87 NPC1 (0.43) CCNE1CDK2ADORA1CCNB2CCNE2
SCHEMBL31333951 0.86 ADORA1 (0.41) CCNE1CDK2ADORA1CCNB2CCNE2
SCHEMBL31334517 0.86 CSNK2A2 (0.49) MAPK8MAPK9MAPK10MAPK14MCHR1
SCHEMBL31333197 0.86 MAPK3 (0.41) CCNE1CDK2ADORA1CCNB2CCNE2
SCHEMBL31333944 0.84 ADORA1 (0.49) MAPK8MAPK9MAPK10MAPK14CCNE1

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