SCHEMBL30477209

SCHEMBL30477209

N#Cc1cccc(-c2cc(-c3ccccn3)cn(-c3ccccc3)c2=O)c1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.69
GRIA3 P42263 1/20 0.69
PDE4D Q08499 1/20 0.69
GRM5 P41594 13/20 0.54
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
CLK4 Q9HAZ1 1/20 0.43

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
SCHEMBL1885494 1.00 GRIA1 (0.69) GRIA1GRIA3PDE4DGRM5KDM4E
SCHEMBL1887019 0.89 GRIA1 (0.72) GRIA1GRIA3PDE4DGRM5KDM4E
SCHEMBL1884948 0.86 GRIA1 (0.70) GRIA1GRIA3PDE4DGRM5MAPT
SCHEMBL1884881 0.84 GRIA1 (0.82) GRIA1GRIA3PDE4DGRM5KDM4E
SCHEMBL1890140 0.83 GRIA1 (0.67) GRIA1GRIA3PDE4DGRM5
SCHEMBL1885398 0.83 GRIA1 (0.60) GRIA1GRIA3PDE4DGRM5TSHR
SCHEMBL1884361 0.83 GRIA1 (0.60) GRIA1GRIA3PDE4DGRM5KDM4E
SCHEMBL1884288 0.83 GRIA1 (0.60) GRIA1GRIA3PDE4DGRM5
SCHEMBL1889782 0.83 GRIA1 (0.60) GRIA1GRIA3PDE4DGRM5MAPT
SCHEMBL1880087 0.82 GRIA1 (0.69) GRIA1GRIA3PDE4DGRM5KDM4E

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-116429937-A Detection method for related substances in pirenzepine bulk drug and application thereof 山东达因海洋生物制药股份有限公司 2023-07-14 CN claimed