SCHEMBL16348374

SCHEMBL16348374

COC(=O)C(Oc1ccc(Cl)cc1-c1nc(CCl)co1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.41
PPARG P37231 2/20 0.41
ALDH1A1 P00352 3/20 0.41
NPSR1 Q6W5P4 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.40
DRD2 P14416 6/20 0.39
DRD4 P21917 6/20 0.39
DRD3 P35462 6/20 0.39
LMNA P02545 2/20 0.37
CTSA P10619 2/20 0.37
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
F9 P00740 1/20 0.36
F10 P00742 1/20 0.36
PLAU P00749 1/20 0.36
KMT2A Q03164 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
SCHEMBL16348439 0.90 PPARA (0.52) PPARAPPARGALDH1A1NPSR1L3MBTL1
SCHEMBL16348390 0.83 PPARA (0.49) PPARAPPARGALDH1A1NPSR1L3MBTL1
SCHEMBL16348355 0.80 KMT2A (0.45) PPARAPPARGALDH1A1NPSR1L3MBTL1
SCHEMBL16348377 0.80 PPARA (0.47) PPARAPPARGALDH1A1NPSR1L3MBTL1
SCHEMBL16348437 0.80 PPARA (0.47) PPARAPPARGPTGDR2DRD2DRD4
SCHEMBL16348391 0.78 PPARG (0.48) PPARAPPARGPTGDR2DRD2DRD4
SCHEMBL16348403 0.78 PPARA (0.54) PPARAPPARGALDH1A1NPSR1L3MBTL1
SCHEMBL16348442 0.77 PPARA (0.44) PPARAPPARGPTGDR2KMT2A
SCHEMBL13523077 0.76 SIRT1 (0.48) NPSR1LMNAMAPTTDP1
SCHEMBL16348401 0.75 PPARG (0.47) PPARAPPARGALDH1A1

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-7642358-B2 Substituted phenylacetic acids METABOLEX, INC. (US) 2010-01-05 US disclosed
US-7642358-B2 Substituted phenylacetic acids METABOLEX, INC. (US) 2010-01-05 US disclosed