SCHEMBL6853949

SCHEMBL6853949

COc1cc(C(=O)NCC2CCCN(Cc3cccc(C(F)(F)F)c3)C2)ccc1-n1cnc(C)c1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 8/20 0.71
PSEN2 P49810 8/20 0.71
APH1B Q8WW43 8/20 0.71
NCSTN Q92542 8/20 0.71
APH1A Q96BI3 8/20 0.71
PSENEN Q9NZ42 8/20 0.71
ALDH1A1 P00352 2/20 0.62
POLB P06746 1/20 0.52
GAA P10253 1/20 0.52
ATM Q13315 1/20 0.51
KCNH2 Q12809 2/20 0.50
LMNA P02545 1/20 0.48
CACNA1I Q9P0X4 1/20 0.47
BCHE P06276 1/20 0.47
KMT2A Q03164 1/20 0.47
MCHR1 Q99705 1/20 0.47
CCR2 P41597 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
SCHEMBL6853933 0.89 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6854642 0.89 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6853452 0.87 PSEN1 (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL759619 0.83 PSEN1 (1.00) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6853598 0.83 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6853583 0.81 PSEN1 (0.56) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6854971 0.81 PSEN1 (0.63) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL759041 0.81 PSEN1 (0.84) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL761094 0.80 PSEN1 (0.65) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6853471 0.80 PSEN1 (0.65) 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