SCHEMBL461735

SCHEMBL461735

N#Cc1ccc(CNS(=O)(=O)c2ccc(Cl)cc2[C@@H](CCC(F)(F)F)C(N)=O)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 5/20 0.53
PSEN2 P49810 5/20 0.53
APH1B Q8WW43 5/20 0.53
NCSTN Q92542 5/20 0.53
APH1A Q96BI3 5/20 0.53
PSENEN Q9NZ42 5/20 0.53
TRPV4 Q9HBA0 13/20 0.42
DDR1 Q08345 1/20 0.38

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
SCHEMBL327592 0.74 PSEN1 (0.39) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL15827665 0.72 PSEN1 (0.51) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL310492 0.69 PSEN1 (1.00) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10306793 0.65 PSEN1 (0.64) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14798069 0.64 FFAR1 (0.41)
SCHEMBL1644539 0.62 PSEN1 (0.83) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL17210773 0.61 FFAR1 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28566235 0.60 TRPV4 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20743667 0.60 KCNH2 (0.44) TRPV4
SCHEMBL30309606 0.60 KCNH2 (0.44) TRPV4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2408450-A1 A NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUND AS AN INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION Bristol-Myers Squibb Company (US) 2012-01-25 EP disclosed
WO-2010107435-A1 A NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUND AS AN INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2010-09-23 WO disclosed