SCHEMBL1228352

SCHEMBL1228352

O=C(O)c1ccccc1ON=Nc1cccc(S(=O)(=O)Nc2ccccn2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 8/20 0.57
ALDH1A1 P00352 5/20 0.56
SLC7A11 Q9UPY5 4/20 0.56
LMNA P02545 2/20 0.56
MEN1 O00255 2/20 0.56
MAPK1 P28482 2/20 0.56
KMT2A Q03164 2/20 0.56
ABCC3 O15438 1/20 0.56
ABCC4 O15439 1/20 0.56
USP2 O75604 1/20 0.56
SLCO2B1 O94956 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
MMP1 P03956 1/20 0.56
ABCB1 P08183 1/20 0.56
MAPT P10636 1/20 0.56
CYP2C9 P11712 1/20 0.56
HPGD P15428 1/20 0.56
TSHR P16473 1/20 0.56
NFKB1 P19838 1/20 0.56

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
SCHEMBL11421910 0.89 SLC7A11 (0.64) BRD4ALDH1A1SLC7A11LMNAMEN1
Sulfasalazine SCHEMBL27891148 0.73 SLC7A11 (0.79) BRD4ALDH1A1SLC7A11LMNAMEN1
SCHEMBL32662838 0.72 SLC7A11 (0.71) BRD4ALDH1A1SLC7A11LMNAMEN1
SCHEMBL6885835 0.72 KDM4E (0.50) ALDH1A1LMNAMEN1KMT2AUSP2
SCHEMBL10794987 0.72 KMT2A (0.46) ALDH1A1LMNAMEN1KMT2AUSP2
Sulfasalazine SCHEMBL10289061 0.72 SLC7A11 (1.00) BRD4ALDH1A1SLC7A11LMNAMEN1
Sulfasalazine SCHEMBL5664970 0.72 SLC7A11 (1.00) BRD4ALDH1A1SLC7A11LMNAMEN1
Sulfasalazine SCHEMBL4514 0.72 SLC7A11 (1.00) BRD4ALDH1A1SLC7A11LMNAMEN1
Sulfasalazine SCHEMBL487664 0.72 SLC7A11 (1.00) BRD4ALDH1A1SLC7A11LMNAMEN1
Sulfasalazine SCHEMBL4515 0.72 SLC7A11 (1.00) BRD4ALDH1A1SLC7A11LMNAMEN1

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
US-7881871-B2 Method for designing surfaces BIO-LAYER PTY LIMITED (AU) 2011-02-01 US claimed
US-20070099235-A1 Method for designing surfaces BIO-LAYER PTY LIMITED (AU) 2007-05-03 US claimed