SCHEMBL7325484

SCHEMBL7325484

CCCC[C@@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 2/20 0.43
MME P08473 2/20 0.41
BIRC2 Q13490 3/20 0.41
CTSS P25774 1/20 0.39
CTSD P07339 2/20 0.38
PSMB5 P28074 1/20 0.38
MMP3 P08254 2/20 0.37
MMP9 P14780 2/20 0.37
REN P00797 1/20 0.37
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
PLA2G2A P14555 2/20 0.36
PLA2G5 P39877 2/20 0.36

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
SCHEMBL7333517 0.88 PLA2G10 (0.58) PLA2G10PSMB5PLA2G2APLA2G5
SCHEMBL7335388 0.86 PLA2G10 (0.60) PLA2G10PSMB5PLA2G2APLA2G5
SCHEMBL7376759 0.86 PLA2G10 (0.60) PLA2G10PSMB5PLA2G2APLA2G5
SCHEMBL8972235 0.86 ALDH1A1 (0.47) PLA2G10BIRC2CTSSMMP3MMP9
SCHEMBL28564205 0.86 ALDH1A1 (0.47) PLA2G10BIRC2CTSSMMP3MMP9
SCHEMBL4367034 0.84 ALDH1A1 (0.46) PLA2G10BIRC2CTSSMMP3MMP9
SCHEMBL7328537 0.82 HDAC2 (0.48) MMEBIRC2MMP3MMP9REN
SCHEMBL7371455 0.81 CAPN1 (0.42) PLA2G10BIRC2CTSSPSMB5
SCHEMBL9064502 0.80 PLA2G10 (0.48) PLA2G10BIRC2MMP3MMP9PLA2G2A
SCHEMBL7327504 0.80 CTSK (0.54) PLA2G10BIRC2CTSSPSMB5MMP3

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-5510531-A ANTIINFLAMMATROY AGENTS, MUSCULAR DISORDERS SUNTORY LIMITED (JP) 1996-04-23 US disclosed
EP-0393457-B1 Proteinase inhibitor SUNTORY LTD (JP) 1994-07-06 EP disclosed
US-5081284-A N-Oxomethyl-Substituted Peptide SUNTORY LIMITED (JP) 1992-01-14 US disclosed
EP-0393457-A1 Proteinase inhibitor SUNTORY LIMITED (JP) 1990-10-24 EP disclosed