SCHEMBL7576079

SCHEMBL7576079

O=C(CCC(=O)OCCOc1ccccc1)OCCOc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
RAB9A P51151 3/20 0.61
NPC1 O15118 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
TSHR P16473 1/20 0.61
PKM P14618 1/20 0.60
ALDH1A1 P00352 3/20 0.57
KDM4E B2RXH2 1/20 0.57
MEN1 O00255 1/20 0.57
HPGD P15428 1/20 0.57
NFKB1 P19838 1/20 0.57
NFKB2 Q00653 1/20 0.57
KMT2A Q03164 1/20 0.57
RELA Q04206 1/20 0.57
HSD17B10 Q99714 1/20 0.57
PARP10 Q53GL7 1/20 0.56
KCNA3 P22001 1/20 0.54
RECQL P46063 1/20 0.54
CYP1A2 P05177 1/20 0.53

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
SCHEMBL7576075 0.94 THRB (0.57) THRBTDP1RAB9ANPC1SMN1; SMN2
SCHEMBL10336969 0.92 THRB (0.59) THRBTDP1RAB9ANPC1SMN1; SMN2
SCHEMBL27940429 0.92 THRB (0.59) THRBTDP1RAB9ANPC1SMN1; SMN2
SCHEMBL11717154 0.90 ALDH1A1 (0.59) THRBTDP1RAB9ANPC1SMN1; SMN2
SCHEMBL10724161 0.90 HDAC1 (0.60) THRBTDP1RAB9ANPC1SMN1; SMN2
SCHEMBL28578725 0.90 HDAC1 (0.60) THRBTDP1RAB9ANPC1SMN1; SMN2
SCHEMBL3640377 0.89 THRB (0.56) THRBTDP1RAB9ANPC1SMN1; SMN2
SCHEMBL8895277 0.89 THRB (0.60) THRBTDP1RAB9ANPC1SMN1; SMN2
SCHEMBL10528978 0.89 THRB (0.56) THRBTDP1RAB9ANPC1SMN1; SMN2
SCHEMBL16134247 0.88 RAB9A (0.66) THRBRAB9ANPC1SMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103610669-B Di- (p-alkoxy benzene acrylketone) glutathione-S-transsulfurase latent inhibitor 重庆医科大学 2018-03-27 CN disclosed
CN-103610669-A Di- (p-alkoxy benzene acrylketone) glutathione-S-transsulfurase latent inhibitor UNIV CHONGQING MEDICAL 2014-03-05 CN disclosed
EP-0876467-B1 PERFUMES FOR LAUNDRY COMPOSITIONS PROCTER & GAMBLE (US) 2002-09-18 EP disclosed
EP-1019479-A1 DRYER-ACTIVATED FABRIC CONDITIONING AND ANTISTATIC COMPOSITIONS WITH IMPROVED PERFUME LONGEVITY THE PROCTER & GAMBLE COMPANY (US) 2000-07-19 EP disclosed
EP-0876467-A1 PERFUMES FOR LAUNDRY AND CLEANING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-11-11 EP disclosed
US-5721202-A Perfumes for laundry and cleaning composition THE PROCTER & GAMBLE COMPANY (US) 1998-02-24 US disclosed
WO-1997016523-A1 PERFUMES FOR LAUNDRY AND CLEANING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-05-09 WO disclosed
WO-1997016522-A1 DRYER-ACTIVATED FABRIC CONDITIONING AND ANTISTATIC COMPOSITIONS WITH IMPROVED PERFUME LONGEVITY THE PROCTER & GAMBLE COMPANY (US) 1997-05-09 WO disclosed
US-5562847-A QUATERNARY AMMONIUM SOFTENING COMPOUND AND THE ESTER OF A PERFUME ALCOHOL THE PROCTER & GAMBLE COMPANY (US) 1996-10-08 US disclosed
US-4975353-A Support and layer of diazo compound, coupling component for coloration and basic compound FUJI PHOTO FILM CO., LTD. (JP) 1990-12-04 US disclosed
US-4895826-A STORAGE STABILITY; DISCOLORATION INHIBITION FUJI PHOTO FILM CO., LTD. (JP) 1990-01-23 US disclosed
US-4846883-A AROMATIC OXYALKYL ESTERS REANAL FINOMVEGYSZERGYAR (HU) 1989-07-11 US disclosed
EP-0288240-A2 Heat-sensitive diazo recording material FUJI PHOTO FILM CO., LTD. (JP) 1988-10-26 EP disclosed
EP-0224551-A1 NEW SUCCINIC ACID DERIVATIVES, PLANT GROWTH REGULATING COMPOSITIONS CONTAINING THEM AND A PROCESS FOR THE PREPARATION THEREOF REANAL FINOMVEGYSZERGYAR (HU) 1987-06-10 EP disclosed
WO-1986007354-A1 NEW SUCCINIC ACID DERIVATIVES, PLANT GROWTH REGULATING COMPOSITIONS CONTAINING THEM AND A PROCESS FOR THE PREPARATION THEREOF REANAL FINOMVEGYSZERGYÁR (HU) 1986-12-18 WO disclosed
US-4036984-A PHENOXYETHYL FATTY ACID ESTER NISSAN CHEMICAL INDUSTRIES, LTD. (JA) 1977-07-19 US disclosed