SCHEMBL8228680

SCHEMBL8228680

Cc1cc(CNC(=O)c2cc(C(=O)NCc3ccc4oc(=O)n(C)c4c3)nc3ccnn23)ccc1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 4/20 0.45
MMP8 P22894 2/20 0.45
ADAMTS4 O75173 2/20 0.45
MMP3 P08254 2/20 0.45
MMP12 P39900 1/20 0.45
NR1H4 Q96RI1 1/20 0.40
TP53 P04637 3/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
MMP10 P09238 1/20 0.36
MMP9 P14780 1/20 0.36
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
MAPT P10636 4/20 0.36
LMNA P02545 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 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
SCHEMBL10162891 0.92 MMP13 (0.40) MMP13MMP8ADAMTS4MMP3MMP12
SCHEMBL8219948 0.91 ADAMTS4 (0.43) MMP13MMP8ADAMTS4MMP3MMP12
SCHEMBL8227479 0.91 MEN1 (0.44) MMP13MMP8ADAMTS4MMP3MMP12
SCHEMBL8228615 0.89 MMP13 (0.50) MMP13MMP8ADAMTS4MMP3MMP12
SCHEMBL10162873 0.89 TP53 (0.44) MMP13MMP8ADAMTS4MMP3MMP12
SCHEMBL10162840 0.89 L3MBTL1 (0.48) MMP13MMP8ADAMTS4MMP3MMP12
SCHEMBL10162874 0.88 MMP13 (0.38) MMP13MMP8ADAMTS4MMP3MMP12
SCHEMBL10162842 0.88 MMP13 (0.41) MMP13MMP8ADAMTS4MMP3MMP12
SCHEMBL10162888 0.87 MMP13 (0.39) MMP13MMP8ADAMTS4MMP3MMP12
SCHEMBL10162862 0.87 TP53 (0.40) MMP13MMP8ADAMTS4MMP3MMP12

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-2007139856-A2 HETEROBICYCLIC METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS, INC. (US) 2007-12-06 WO disclosed