SCHEMBL31334973

SCHEMBL31334973

CC(=O)N[C@H]1CC[C@H](Nc2ncc(F)c(-c3cccc(-c4cc[nH]c(=O)c4)c3)n2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 4/20 0.41
MAPK14 Q16539 1/20 0.41
MCHR1 Q99705 5/20 0.40
MAPK9 P45984 3/20 0.40
MAPK10 P53779 3/20 0.40
MAPK1 P28482 4/20 0.39
ADORA1 P30542 2/20 0.39
ADRA2A P08913 2/20 0.39
ADRA1A P35348 2/20 0.39
HRH1 P35367 2/20 0.39
HTR2B P41595 2/20 0.39
CDK2 P24941 3/20 0.38
CCNE1 P24864 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
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38
CCNB3 Q8WWL7 1/20 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
SCHEMBL31333452 0.89 MAPK8 (0.50) MAPK8MAPK14MCHR1MAPK9MAPK10
SCHEMBL31334673 0.88 MAPK8 (0.40) MAPK8MAPK14MCHR1MAPK9MAPK10
SCHEMBL31333585 0.88 ADORA1 (0.41) MAPK1ADORA1CDK2CCNE1CCNB2
SCHEMBL31334225 0.88 MAPK14 (0.45) MAPK8MAPK14MAPK9MAPK10MAPK1
SCHEMBL31333221 0.87 ADORA1 (0.39) MAPK1ADORA1CDK2CCNE1CCNB2
SCHEMBL31335133 0.86 CCNE1 (0.43) MAPK8MAPK14MCHR1MAPK9MAPK10
SCHEMBL31334517 0.84 CSNK2A2 (0.49) MAPK8MAPK14MCHR1MAPK9MAPK10
SCHEMBL31333835 0.82 MCHR1 (0.44) MAPK8MAPK14MCHR1MAPK9MAPK10
SCHEMBL31333885 0.82 MAPK3 (0.40) MAPK1ADORA1CDK2CCNE1ADORA2A
SCHEMBL31334783 0.82 MAPK8 (0.45) MAPK8MAPK14MCHR1MAPK9MAPK10

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