SCHEMBL30783231

SCHEMBL30783231

Cc1ncccc1C1CN(C(=O)OC(C)(C)C)CC/C1=N\O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
GPR119 Q8TDV5 4/20 0.42
GRM5 P41594 4/20 0.41
GRM1 Q13255 3/20 0.39
PDE10A Q9Y233 1/20 0.39
USP30 Q70CQ3 2/20 0.38
MAPT P10636 1/20 0.38
DTYMK P23919 1/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
GCK P35557 1/20 0.38
MAPK1 P28482 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
SCHEMBL21748845 1.00 POLB (0.43) POLBGPR119GRM5GRM1PDE10A
SCHEMBL21748843 1.00 POLB (0.43) POLBGPR119GRM5GRM1PDE10A
SCHEMBL21748717 0.86 POLB (0.45) POLBGPR119GRM5GRM1USP30
SCHEMBL21773364 0.79 USP30 (0.46) GPR119USP30MAPK1
SCHEMBL4481228 0.79 USP30 (0.46) GPR119USP30MAPK1
SCHEMBL4481232 0.79 USP30 (0.46) GPR119USP30MAPK1
SCHEMBL30783224 0.77 JAK2 (0.52) POLBGPR119
SCHEMBL21775442 0.76 GPR119 (0.50) POLBGPR119USP30GCK
SCHEMBL30783205 0.76 GPR119 (0.50) POLBGPR119USP30GCK
SCHEMBL21748693 0.76 GPR119 (0.50) POLBGPR119USP30GCK

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
CN-112236423-B Piperidinyl-3- (aryloxy) propanamides and propionic acid esters 武田药品工业株式会社 2024-02-06 CN disclosed