SCHEMBL7576072

SCHEMBL7576072

CC(OC(=O)CCC(=O)OC(C)Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.47
MTNR1B P49286 1/20 0.47
ACE P12821 1/20 0.45
TSHR P16473 1/20 0.44
ALDH1A1 P00352 2/20 0.43
GAA P10253 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
PKM P14618 1/20 0.43
CYP2C19 P33261 1/20 0.43
FFAR1 O14842 1/20 0.43
PPARG P37231 5/20 0.42
PPARA Q07869 5/20 0.42
MAPT P10636 2/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL10535975 0.95 FFAR1 (0.47) MTNR1AMTNR1BACETSHRALDH1A1
SCHEMBL7753878 0.91 MTNR1A (0.44) MTNR1AMTNR1BTSHRALDH1A1GAA
SCHEMBL10528965 0.90 MTNR1A (0.43) MTNR1AMTNR1BACETSHRALDH1A1
SCHEMBL10527159 0.89 ALDH1A1 (0.45) MTNR1AMTNR1BTSHRALDH1A1GAA
SCHEMBL974817 0.87 MTNR1A (0.46) MTNR1AMTNR1BTSHRALDH1A1GAA
SCHEMBL29175524 0.87 LMNA (0.51) MTNR1AMTNR1BALDH1A1CYP1A2MAPT
SCHEMBL14698120 0.86 LMNA (0.54) TSHRALDH1A1CYP1A2CYP2C9MAPT
SCHEMBL7492100 0.86 LMNA (0.54) TSHRALDH1A1CYP1A2CYP2C9MAPT
SCHEMBL15988450 0.86 LMNA (0.54) TSHRALDH1A1CYP1A2CYP2C9MAPT
SCHEMBL29743339 0.86 FAAH (0.51) PKMFFAR1PPARGPPARALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-4846883-A AROMATIC OXYALKYL ESTERS REANAL FINOMVEGYSZERGYAR (HU) 1989-07-11 US 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