SCHEMBL7553689

SCHEMBL7553689

CCCCCCCCCc1ccccc1O.CCCCOCCCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.53
BID P55957 3/20 0.53
MCL1 Q07820 3/20 0.53
BCL2L1 Q07817 2/20 0.53
BAK1 Q16611 2/20 0.53
KAT8 Q9H7Z6 2/20 0.53
PPARG P37231 1/20 0.53
PPARA Q07869 1/20 0.53
EP300 Q09472 1/20 0.53
KAT2A Q92830 1/20 0.53
KAT2B Q92831 1/20 0.53
KAT5 Q92993 1/20 0.53
SAE1 Q9UBE0 1/20 0.53
ALOX5 P09917 2/20 0.51
TYR P14679 2/20 0.51
MEN1 O00255 1/20 0.51
TP53 P04637 1/20 0.51
CYP3A4 P08684 1/20 0.51
MAPT P10636 1/20 0.51
ALOX15 P16050 1/20 0.51

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
Butoxyethanol SCHEMBL9660780 0.94 MEN1 (0.52) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL20237256 0.93 BID (0.49) LIPGBIDMCL1BCL2L1BAK1
Ethylene Glycol SCHEMBL11471133 0.92 BID (0.49) LIPGBIDMCL1BCL2L1BAK1
Di(Hydroxyethyl)Ether SCHEMBL11515451 0.90 MEN1 (0.51) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL31651139 0.90 HTR1A (0.47) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL27935814 0.90 HTR1A (0.50) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL157630 0.89 LIPG (0.63) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL272645 0.89 LIPG (0.63) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL223052 0.89 LIPG (0.63) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL9321974 0.89 LIPG (0.63) LIPGBIDMCL1BCL2L1BAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1214388-A1 TOILET BOWL CLEANING METHOD S.C. JOHNSON & SON, INC. (US) 2002-06-19 EP disclosed
WO-2001019944-A1 TOILET BOWL CLEANING METHOD S.C. JOHNSON & SON, INC. (US) 2001-03-22 WO disclosed
WO-2001002285-A1 METHOD OF AND APPARATUS FOR DISPENSING DILUTED PRODUCTS USING VENTURI MIXING MEANS ECOLAB INC. (US) 2001-01-11 WO disclosed