SCHEMBL3687103

SCHEMBL3687103

CC(NS(=O)(=O)c1ccccc1)C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 2/20 0.61
ALDH1A1 P00352 4/20 0.60
HSD17B10 Q99714 3/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
SLC1A3 P43003 2/20 0.54
SLC1A2 P43004 2/20 0.54
SLC1A1 P43005 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.51
LMNA P02545 1/20 0.51
MMP2 P08253 4/20 0.50
MMP3 P08254 3/20 0.50
MMP13 P45452 3/20 0.50
MMP1 P03956 2/20 0.50
MMP7 P09237 2/20 0.50
MMP9 P14780 2/20 0.50
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
HPGD P15428 1/20 0.50
HTT P42858 1/20 0.49

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
SCHEMBL791357 1.00 ADAMTS4 (0.61) ADAMTS4ALDH1A1HSD17B10L3MBTL1SLC1A3
SCHEMBL1798546 0.86 MMP9 (0.67) ADAMTS4ALDH1A1HSD17B10L3MBTL1SMN1; SMN2
SCHEMBL1798547 0.86 MMP9 (0.67) ADAMTS4ALDH1A1HSD17B10L3MBTL1SMN1; SMN2
SCHEMBL790069 0.85 ADAMTS4 (0.81) ADAMTS4ALDH1A1HSD17B10L3MBTL1SLC1A3
SCHEMBL702793 0.85 ADAMTS4 (0.81) ADAMTS4ALDH1A1HSD17B10L3MBTL1SLC1A3
SCHEMBL702794 0.85 ADAMTS4 (0.81) ADAMTS4ALDH1A1HSD17B10L3MBTL1SLC1A3
SCHEMBL1903552 0.84 SLC1A3 (0.56) ADAMTS4ALDH1A1HSD17B10SLC1A3SLC1A2
SCHEMBL11578980 0.84 ADAMTS4 (0.59) ADAMTS4ALDH1A1HSD17B10L3MBTL1SLC1A3
SCHEMBL17318887 0.83 ADAMTS4 (0.62) ADAMTS4ALDH1A1HSD17B10L3MBTL1SLC1A3
SCHEMBL1906746 0.82 KMT2A (0.51) ALDH1A1HPGD

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
WO-2010014744-A1 INHIBITORS OF HEPATITIS C VIRUS INFECTION THE SCRIPPS RESEARCH INSTITUTE (US) 2010-02-04 WO claimed