SCHEMBL4698531

SCHEMBL4698531

CCCC[Si](C)(C)N1C(=O)CC1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACE P12821 3/20 0.33
ITGB1 P05556 1/20 0.33
ITGA5 P08648 1/20 0.33
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CYP2C19 P33261 1/20 0.32
POLB P06746 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PRKCA P17252 4/20 0.31

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
SCHEMBL7417722 0.76 POLB (0.40) ACEITGB1ITGA5KMT2APOLB
SCHEMBL10362062 0.76 ITGB1 (0.39) ACEITGB1ITGA5CASP1CASP7
SCHEMBL6942583 0.76 ITGB1 (0.39) ACEITGB1ITGA5CASP1CASP7
SCHEMBL10361083 0.76 ITGB1 (0.39) ACEITGB1ITGA5CASP1CASP7
SCHEMBL9197329 0.74 ALDH1A1 (0.33) ALDH1A1GAAMAPTTHRB
SCHEMBL9194062 0.72 ALDH1A1 (0.31) ALDH1A1GAAMAPTTHRB
SCHEMBL9079730 0.72 RIPK1 (0.44) MEN1KMT2APOLBALDH1A1
SCHEMBL31742451 0.71 ACE (0.40) ACEMEN1KMT2APOLBALDH1A1
SCHEMBL760161 0.70 POLB (0.39) ITGB1ITGA5POLBMAPT
SCHEMBL2540013 0.70 POLB (0.39) ITGB1ITGA5POLBMAPT

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-1871741-A2 SUBSTITUTED AZETIDINONES Daiamed, Inc. (US) 2008-01-02 EP disclosed
WO-2006108039-A2 SUBSTITUTED AZETIDINONES DAIAMED, INC. (US) 2006-10-12 WO disclosed