SCHEMBL9464883

SCHEMBL9464883

O=C1OC(c2ccccc2)=NC1=Cc1cccc(Cl)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAPK3 O43293 7/20 0.69
GAA P10253 1/20 0.59
NOTUM Q6P988 1/20 0.58
PLCG2 P16885 1/20 0.58
ALOX5 P09917 2/20 0.57
CSNK2A2 P19784 1/20 0.56
CSNK2B P67870 1/20 0.56
CSNK2A1 P68400 1/20 0.56
F2 P00734 1/20 0.55
F10 P00742 1/20 0.55
PLG P00747 1/20 0.55
PLAU P00749 1/20 0.55
PLAT P00750 1/20 0.55
KLKB1 P03952 1/20 0.55
KDM4E B2RXH2 2/20 0.54
ALDH1A1 P00352 2/20 0.54
MAPT P10636 2/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL9464880 1.00 DAPK3 (0.69) DAPK3GAANOTUMPLCG2ALOX5
SCHEMBL9464738 0.93 DAPK3 (0.75) DAPK3GAANOTUMPLCG2ALOX5
SCHEMBL9464734 0.93 DAPK3 (0.75) DAPK3GAANOTUMPLCG2ALOX5
SCHEMBL6791976 0.88 DAPK3 (0.61) DAPK3GAANOTUMALOX5CSNK2A2
SCHEMBL6791970 0.88 DAPK3 (0.61) DAPK3GAANOTUMALOX5CSNK2A2
SCHEMBL2131615 0.86 DAPK3 (0.75) DAPK3GAANOTUMPLCG2ALOX5
SCHEMBL2131623 0.86 DAPK3 (0.75) DAPK3GAANOTUMPLCG2ALOX5
SCHEMBL4691058 0.86 DAPK3 (0.75) DAPK3GAANOTUMPLCG2ALOX5
SCHEMBL24418239 0.85 ALOX5 (0.71) DAPK3GAANOTUMPLCG2ALOX5
SCHEMBL6795692 0.85 DAPK3 (0.73) DAPK3GAANOTUMPLCG2ALOX5

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
US-5254548-A Treating dysfunction of cholinergic system ADIR ET COMPAGNIE (FR) 1993-10-19 US disclosed