SCHEMBL7301669

SCHEMBL7301669

CC(C)(C)OC(=O)NC(=O)[C@H](Cc1ccccc1)C[C@H](O)[C@@H](N)Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
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
KLK5 Q9Y337 2/20 0.46
CTSS P25774 2/20 0.46
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46
CTSK P43235 1/20 0.46
ATM Q13315 1/20 0.45
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
REN P00797 3/20 0.43
ENPEP Q07075 1/20 0.42
ACE P12821 1/20 0.42
LAP3 P28838 2/20 0.41
ANPEP P15144 1/20 0.41

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
SCHEMBL7290790 0.87 PSEN1 (0.63) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7293225 0.85 PSEN1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7301022 0.85 PSEN1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7290892 0.84 PSEN1 (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7301837 0.81 PSEN1 (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL31506428 0.81 ATM (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL22305235 0.81 ATM (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2059435 0.81 ATM (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8910000 0.81 ATM (0.61) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5541452 0.81 ATM (0.61) 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
EP-0337714-A2 HIV protease inhibitors useful for the treatment of aids MERCK & CO. INC. (US) 1989-10-18 EP disclosed