SCHEMBL4036667

SCHEMBL4036667

CC(C)(C)OC(=O)NC(Cc1ccccc1)C(O)CCN

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KLK5 Q9Y337 3/20 0.62
PSEN1 P49768 4/20 0.54
PSEN2 P49810 4/20 0.54
APH1B Q8WW43 4/20 0.54
NCSTN Q92542 4/20 0.54
APH1A Q96BI3 4/20 0.54
PSENEN Q9NZ42 4/20 0.54
APP P05067 1/20 0.54
ATM Q13315 1/20 0.53
CTSS P25774 3/20 0.51
CTSK P43235 2/20 0.51
CTSL P07711 1/20 0.51
CTSB P07858 1/20 0.51
ACE P12821 1/20 0.49
REN P00797 2/20 0.47
CTSD P07339 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
SCHEMBL4038412 1.00 KLK5 (0.62) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL4036632 1.00 KLK5 (0.62) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL1602032 0.90 KLK5 (0.65) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL1601995 0.90 KLK5 (0.65) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL15005231 0.90 KLK5 (0.65) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL3031552 0.90 KLK5 (0.65) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL15005230 0.90 KLK5 (0.65) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL10788604 0.89 KLK5 (0.64) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL7398543 0.88 KLK5 (0.62) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL21986636 0.88 KLK5 (0.62) KLK5PSEN1PSEN2APH1BNCSTN

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-1641801-B9 BRIDGED N-ARYLSULFONYLPIPERIDINES AS GAMMA-SECRETASE INHIBITORS SCHERING CORP (US) 2009-02-25 EP claimed
EP-1641801-B1 BRIDGED N-ARYLSULFONYLPIPERIDINES AS GAMMA-SECRETASE INHIBITORS SCHERING CORP (US) 2008-07-16 EP claimed