SCHEMBL6157945

SCHEMBL6157945

CCCCCCCCCCCCc1cc(-n2nc3ccccc3n2)cc(C)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
MAPT P10636 3/20 0.40
TYR P14679 2/20 0.40
CYP3A4 P08684 2/20 0.40
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TLR8 Q9NR97 1/20 0.40
LIPG Q9Y5X9 1/20 0.39
ALOX5 P09917 6/20 0.38
TDP1 Q9NUW8 2/20 0.38
TP53 P04637 2/20 0.38
MEN1 O00255 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
SCHEMBL27536922 0.84 TYR (0.34) MAPTTYRCYP3A4KDM4EALOX5
SCHEMBL9628169 0.80 NPC1 (0.56) MAPTTYRCYP3A4KDM4EUSP2
SCHEMBL7241563 0.80 NPC1 (0.56) MAPTTYRCYP3A4KDM4EUSP2
SCHEMBL710489 0.80 NPC1 (0.56) MAPTTYRCYP3A4KDM4EUSP2
SCHEMBL38926 0.80 NPC1 (0.56) MAPTTYRCYP3A4KDM4EUSP2
SCHEMBL10744136 0.80 NPC1 (0.56) MAPTTYRCYP3A4KDM4EUSP2
SCHEMBL709920 0.80 NPC1 (0.56) MAPTTYRCYP3A4KDM4EUSP2
SCHEMBL9628940 0.80 NPC1 (0.56) MAPTTYRCYP3A4KDM4EUSP2
SCHEMBL7649641 0.80 NPC1 (0.56) MAPTTYRCYP3A4KDM4EUSP2
SCHEMBL710157 0.80 NPC1 (0.56) MAPTTYRCYP3A4KDM4EUSP2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0773982-B2 RINSE ADDED FABRIC SOFTENER COMPOSITIONS CONTAINING ANTIOXIDANTS FOR SUN-FADE PROTECTION FOR FABRICS PROCTER & GAMBLE (US) 2005-03-23 EP disclosed
EP-0773982-B1 RINSE ADDED FABRIC SOFTENER COMPOSITIONS CONTAINING ANTIOXIDANTS FOR SUN-FADE PROTECTION FOR FABRICS PROCTER & GAMBLE (US) 2000-12-06 EP disclosed
US-5854200-A Rinse added fabric softener compositions containing antioxidants for sun-fade protection for fabrics THE PROCTER & GAMBLE COMPANY (US) 1998-12-29 US disclosed
US-5763387-A AMIDE- OR ESTER-CONTAINING AROMATIC ANTIOXIDANT, QUATERNARY AMMONIUM COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 1998-06-09 US disclosed
US-5723435-A Rinse added fabric softener compositions containing antioxidants for sun-fade protection fabrics THE PROCTER & GAMBLE COMPANY (US) 1998-03-03 US disclosed