SCHEMBL31334517

SCHEMBL31334517

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 4/20 0.49
CSNK2B P67870 4/20 0.49
MCHR1 Q99705 7/20 0.48
ADRA2A P08913 4/20 0.48
HRH1 P35367 3/20 0.48
HTR2B P41595 3/20 0.48
ADRA1A P35348 2/20 0.48
MAPK8 P45983 2/20 0.46
MAPK14 Q16539 1/20 0.46
ADORA1 P30542 2/20 0.44
CSNK2A1 P68400 5/20 0.43
FLT3 P36888 1/20 0.43
TYRO3 Q06418 1/20 0.43
MERTK Q12866 1/20 0.43
ADORA2A P29274 1/20 0.42
ADORA2B P29275 1/20 0.42
DHODH Q02127 1/20 0.42
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 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
SCHEMBL31333452 0.91 MAPK8 (0.50) CSNK2A2CSNK2BMCHR1ADRA2AHRH1
SCHEMBL31333835 0.90 MCHR1 (0.44) CSNK2A2CSNK2BMCHR1ADRA2AHRH1
SCHEMBL31333816 0.87 MAPK1 (0.47) CSNK2A2CSNK2BMCHR1ADRA2AHRH1
SCHEMBL31333408 0.86 DYRK2 (0.48) CSNK2A2CSNK2BMAPK14
SCHEMBL31334783 0.86 MAPK8 (0.45) CSNK2A2CSNK2BMCHR1ADRA2AHRH1
SCHEMBL31334061 0.84 ATR (0.45)
SCHEMBL31334973 0.84 MAPK8 (0.41) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL31334021 0.83 CKS1B (0.44) MCHR1MAPK8MAPK14ADORA1FLT3
SCHEMBL31334673 0.83 MAPK8 (0.40) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL31334493 0.83 MAPK8 (0.43) CSNK2A2CSNK2BMCHR1ADRA2AHRH1

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