SCHEMBL7360385

SCHEMBL7360385

NC(=O)C(CCc1ccccc1)C(=O)N(O)c1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.48
PPARA Q07869 9/20 0.48
LTA4H P09960 1/20 0.42
EPHX2 P34913 1/20 0.42
NR3C1 P04150 1/20 0.41
PGR P06401 1/20 0.41
MMP12 P39900 1/20 0.41
MMP13 P45452 1/20 0.41
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SLC1A5 Q15758 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
PTGIR P43119 1/20 0.38
NPY5R Q15761 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL7356441 0.89 EPHX2 (0.42) PPARGPPARALTA4HEPHX2NR3C1
SCHEMBL7358523 0.83 MMP12 (0.44) MMP12MMP13
SCHEMBL7355708 0.81 PPARG (0.48) PPARGPPARANR3C1NPY5R
SCHEMBL7356404 0.79 MMP2 (0.44) LTA4HPGRNPC1ALDH1A1MAPT
SCHEMBL7347546 0.78 RAB9A (0.46) PPARGPPARANR3C1PGRNPC1
SCHEMBL7357170 0.77 PPARG (0.46) PPARGPPARAEPHX2NR3C1SMN1; SMN2
SCHEMBL2170213 0.76 PPARG (0.54) PPARGPPARALTA4HEPHX2MMP12
SCHEMBL7350065 0.75 ALOX5 (0.42) ALDH1A1SMN1; SMN2NPY5R
SCHEMBL7358996 0.72 HDAC1 (0.42) PGRMMP12MMP13NPC1ALDH1A1
SCHEMBL7357356 0.71 ALOX5 (0.54) SMN1; SMN2

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-1009736-A1 MALONIC ACID BASED MATRIX METALLOPROTEINASE INHIBITORS Roche Diagnostics GmbH (DE) 2000-06-21 EP disclosed
WO-1999011608-A1 MALONIC ACID BASED MATRIX METALLOPROTEINASE INHIBITORS ROCHE DIAGNOSTICS GMBH (DE) 1999-03-11 WO disclosed