SCHEMBL5282999

SCHEMBL5282999

CCCC(Oc1ccccc1)Oc1ccc(C(C)=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.55
PPARA Q07869 3/20 0.55
MAOB P27338 2/20 0.50
NPSR1 Q6W5P4 3/20 0.47
HPGD P15428 2/20 0.47
MAPT P10636 4/20 0.46
RAB9A P51151 2/20 0.46
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HTT P42858 1/20 0.46
POLB P06746 1/20 0.45
LTB4R Q15722 1/20 0.44
LTB4R2 Q9NPC1 1/20 0.44
GAA P10253 1/20 0.44
NPC1 O15118 1/20 0.43

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
SCHEMBL1952125 0.83 KMT2A (0.59) KMT2AALDH1A1
SCHEMBL6463009 0.83 SLC6A4 (0.43) PPARGPPARALMNASMN1; SMN2ALDH1A1
SCHEMBL11966974 0.81 MAPT (0.42) PPARGPPARAMAOBNPSR1HPGD
SCHEMBL11967013 0.79 MAPT (0.43) PPARGPPARAMAOBNPSR1HPGD
SCHEMBL11966992 0.79 THRB (0.41) PPARGPPARAMAOBNPSR1HPGD
SCHEMBL5287783 0.78 CA4 (0.52) PPARGPPARAALDH1A1
SCHEMBL5289704 0.78 PPARG (0.58) PPARGPPARAMAOBNPSR1HPGD
SCHEMBL8373045 0.77 ELANE (0.53) PPARGPPARAHPGDMAPTRAB9A
SCHEMBL29208084 0.77 NPSR1 (0.46) PPARGPPARANPSR1MAPTRAB9A
SCHEMBL17309753 0.76 KMT2A (0.62) RAB9ALMNASMN1; SMN2KMT2AALDH1A1

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