SCHEMBL6853529

SCHEMBL6853529

COc1cc(C(=O)NCc2ccc3ccccc3c2)ccc1-n1cnc(C)c1

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 10/20 0.75
PSEN2 P49810 10/20 0.75
APH1B Q8WW43 10/20 0.75
NCSTN Q92542 10/20 0.75
APH1A Q96BI3 10/20 0.75
PSENEN Q9NZ42 10/20 0.75
ALDH1A1 P00352 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
GPR142 Q7Z601 1/20 0.49
GAA P10253 1/20 0.48
DRD2 P14416 2/20 0.48
DRD3 P35462 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
MAPT P10636 1/20 0.47
LMNA P02545 1/20 0.46
NR1H4 Q96RI1 1/20 0.46

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
SCHEMBL759778 0.88 PSEN1 (0.77) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6853565 0.88 PSEN1 (0.80) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL759035 0.86 PSEN1 (0.80) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6853844 0.86 PSEN1 (1.00) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6854342 0.86 PSEN1 (0.71) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL759811 0.86 PSEN1 (0.71) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6852715 0.85 PSEN1 (0.71) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6854886 0.85 PSEN1 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL757078 0.85 PSEN1 (0.82) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL757740 0.85 PSEN1 (0.78) PSEN1PSEN2APH1BNCSTNAPH1A

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-2011059048-A1 NOVEL AMIDE DERIVATIVE 大日本住友製薬株式会社 (JP) 2011-05-19 WO disclosed