SCHEMBL8042568

SCHEMBL8042568

COc1cc(-c2ccc(NCc3ccc(F)c(F)c3F)nn2)ccc1-n1cnc(C)c1

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 19/20 0.73
PSEN2 P49810 19/20 0.73
APH1B Q8WW43 19/20 0.73
NCSTN Q92542 19/20 0.73
APH1A Q96BI3 19/20 0.73
PSENEN Q9NZ42 19/20 0.73
KCNH2 Q12809 2/20 0.53
GPR142 Q7Z601 1/20 0.50

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
SCHEMBL8057884 0.92 PSEN1 (0.72) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8052843 0.90 PSEN1 (0.76) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8055262 0.87 PSEN1 (0.83) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3974308 0.85 PSEN1 (1.00) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8052813 0.83 PSEN1 (0.75) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8054651 0.81 PSEN1 (0.75) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8049420 0.79 PSEN1 (0.73) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3980696 0.79 PSEN1 (0.79) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8039871 0.79 PSEN1 (0.68) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8053457 0.79 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-2009050227-A1 PYRIDAZINE DERIVATIVES FOR INHIBITING BETA AMYLOID PEPTIDE PRODUCTION GLAXO GROUP LIMITED (GB) 2009-04-23 WO disclosed