SCHEMBL23560874

SCHEMBL23560874

C[C@H]1CN(c2cnc(Cl)cn2)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.54
HDAC1 Q13547 2/20 0.54
GPR119 Q8TDV5 3/20 0.49
SUV39H2 Q9H5I1 2/20 0.43
GRM1 Q13255 5/20 0.43
PIK3CD O00329 2/20 0.41
CHRM4 P08173 1/20 0.40
JAK3 P52333 1/20 0.39
BTK Q06187 1/20 0.39
SETD7 Q8WTS6 1/20 0.39
CKS1B P61024 1/20 0.39
SKP1 P63208 1/20 0.39
SKP2 Q13309 1/20 0.39
PANK3 Q9H999 1/20 0.39

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
SCHEMBL29498327 0.86 MAP4K4 (0.54) MAP4K4HDAC1GPR119SUV39H2GRM1
SCHEMBL31104870 0.86 MAP4K4 (0.59) MAP4K4HDAC1GPR119SUV39H2GRM1
SCHEMBL30426551 0.86 MAP4K4 (0.59) MAP4K4HDAC1GPR119SUV39H2GRM1
SCHEMBL31105042 0.86 MAP4K4 (0.54) MAP4K4HDAC1GPR119SUV39H2GRM1
SCHEMBL21484275 0.86 MAP4K4 (0.59) MAP4K4HDAC1GPR119SUV39H2GRM1
SCHEMBL29498324 0.86 MAP4K4 (0.59) MAP4K4HDAC1GPR119SUV39H2GRM1
SCHEMBL21483223 0.86 MAP4K4 (0.59) MAP4K4HDAC1GPR119SUV39H2GRM1
SCHEMBL21460229 0.86 MAP4K4 (0.54) MAP4K4HDAC1GPR119SUV39H2GRM1
SCHEMBL21460227 0.86 MAP4K4 (0.54) MAP4K4HDAC1GPR119SUV39H2GRM1
SCHEMBL30427123 0.86 MAP4K4 (0.54) MAP4K4HDAC1GPR119SUV39H2GRM1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021123291-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-06-24 WO disclosed