SCHEMBL5287783

SCHEMBL5287783

CCCC(Oc1ccccc1)Oc1ccc(OC)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.52
LTA4H P09960 3/20 0.50
PPARG P37231 3/20 0.45
PPARA Q07869 3/20 0.45
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TRPA1 O75762 1/20 0.41
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MMP1 P03956 1/20 0.40
MMP13 P45452 1/20 0.40
CRHBP P24387 1/20 0.39

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
SCHEMBL6463009 0.90 SLC6A4 (0.43) CA4LTA4HPPARGPPARAALDH1A1
SCHEMBL11139896 0.85 SLC6A4 (0.40) CA4LTA4HPPARGPPARAALDH1A1
SCHEMBL10596081 0.82 SLC6A4 (0.41) CA4LTA4HPPARGPPARAALDH1A1
SCHEMBL2993982 0.81 TTR (0.40) LTA4HPPARGPPARA
SCHEMBL5287412 0.81 SLC6A4 (0.40) LTA4HPPARGPPARATAS1R3TAS1R1
SCHEMBL1579516 0.79 SLC6A4 (0.39) LTA4HPPARGPPARA
SCHEMBL17139811 0.79 SLC6A4 (0.39) CA4LTA4HPPARGPPARAALDH1A1
SCHEMBL4453544 0.79 LTA4H (0.47) LTA4HPPARGPPARADRD2DRD3
SCHEMBL5282999 0.78 PPARG (0.55) PPARGPPARAALDH1A1
SCHEMBL8422545 0.78 TDP1 (0.46) PPARGPPARA

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
WO-2006138653-A9 THERMAL RECORDING MATERIALS AND METHODS OF MAKING AND USING THE SAME NASHUA CORP (US) 2007-03-01 WO disclosed
WO-2006138653-A1 THERMAL RECORDING MATERIALS AND METHODS OF MAKING AND USING THE SAME NASHUA CORPORATION (US) 2006-12-28 WO disclosed