SCHEMBL7299117

SCHEMBL7299117

CC(C)(C)OC(=O)NC(=O)[C@H]1CCCN1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRCP P42785 2/20 0.43
SCN9A Q15858 2/20 0.42
SCN3A Q9NY46 1/20 0.42
SCN5A Q14524 1/20 0.42
DPP7 Q9UHL4 1/20 0.39
HTR2C P28335 2/20 0.39
BTK Q06187 1/20 0.38
TLR2 O60603 2/20 0.37
GAA P10253 1/20 0.37
KDM4E B2RXH2 1/20 0.36
EPHX1 P07099 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
HTR2B P41595 1/20 0.35

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
SCHEMBL28232408 1.00 PRCP (0.43) PRCPSCN9ASCN3ASCN5ADPP7
SCHEMBL373560 1.00 PRCP (0.43) PRCPSCN9ASCN3ASCN5ADPP7
SCHEMBL3610491 0.95 SCN9A (0.39) PRCPSCN9ASCN3ASCN5ADPP7
SCHEMBL4630085 0.95 SCN9A (0.39) PRCPSCN9ASCN3ASCN5ADPP7
SCHEMBL3597014 0.92 PRCP (0.39) PRCPSCN9ASCN3ASCN5ABTK
SCHEMBL6872992 0.92 PRCP (0.39) PRCPSCN9ASCN3ASCN5ABTK
SCHEMBL4615012 0.83 PRCP (0.47) PRCPDPP7HTR2CTLR2KDM4E
SCHEMBL13767206 0.82 PRCP (0.56) PRCPSCN9ASCN3ASCN5ADPP7
SCHEMBL5154183 0.80 GAA (0.38) PRCPSCN9ASCN3ASCN5ABTK
SCHEMBL7345915 0.80 PRCP (0.64) PRCPDPP7HTR2CTLR2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5629406-A AMINO ACID DERIVATIVES SANKYO COMPANY, LIMITED (JP) 1997-05-13 US disclosed
CN-1026892-C New amino acid derivatives, process for preparation thereof and pharmaceutical composition comprising same FUJISAWA PHARMACEUTICAL CO (JP) 1994-12-07 CN disclosed
EP-0587311-A1 Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1994-03-16 EP disclosed
CN-1030411-A New amino acid derivatives, its preparation method and contain its pharmaceutical composition FUJISAWA PHARMACEUTICAL CO (JP) 1989-01-18 CN disclosed