SCHEMBL221850

SCHEMBL221850

CCCCCCC(C(=O)OO)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
ASAH1 Q13510 1/20 0.46
POLB P06746 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TP53 P04637 1/20 0.46
GLA P06280 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
HPGD P15428 1/20 0.46
ALOX12 P18054 1/20 0.46
NFKB1 P19838 1/20 0.46
APEX1 P27695 1/20 0.46
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MAPT P10636 1/20 0.44
GAA P10253 1/20 0.43
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
HSD11B1 P28845 1/20 0.42

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
SCHEMBL9898480 1.00 ALDH1A1 (0.46) ALDH1A1ASAH1POLBKDM4ETP53
SCHEMBL4207144 1.00 ALDH1A1 (0.46) ALDH1A1ASAH1POLBKDM4ETP53
SCHEMBL8856843 1.00 ALDH1A1 (0.46) ALDH1A1ASAH1POLBKDM4ETP53
SCHEMBL9899146 1.00 ALDH1A1 (0.46) ALDH1A1ASAH1POLBKDM4ETP53
SCHEMBL9898512 0.99 ALDH1A1 (0.47) ALDH1A1ASAH1POLBKDM4ETP53
SCHEMBL3195963 0.94 ALDH1A1 (0.48) ALDH1A1POLBKDM4ETP53GLA
SCHEMBL21635 0.94 ALDH1A1 (0.48) ALDH1A1POLBKDM4ETP53GLA
SCHEMBL29453019 0.94 ALDH1A1 (0.48) ALDH1A1POLBKDM4ETP53GLA
SCHEMBL29256396 0.89 ASAH1 (0.49) ALDH1A1ASAH1POLBKDM4ETP53
SCHEMBL9899716 0.89 ALDH1A1 (0.50) ALDH1A1POLBKDM4ETP53GLA

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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9752109-B2 Liquid detergent composition ECOLAB USA INC. (US) 2017-09-05 US claimed
WO-2016162067-A1 AQUEOUS CLEANING COMPOSITION FOR CLEANING AND DISINFECTING HARD SURFACES ECOLAB USA INC. (US) 2016-10-13 WO claimed
US-20160137957-A1 LIQUID DETERGENT COMPOSITION ECOLAB USA INC. 2016-05-19 US claimed
EP-2978834-A1 LIQUID DETERGENT COMPOSITION Ecolab USA Inc. (US) 2016-02-03 EP claimed
WO-2014154244-A1 LIQUID DETERGENT COMPOSITION ECOLAB USA INC. (US) 2014-10-02 WO claimed
EP-1240300-B1 WASHING OF DELICATE TEXTILES USING PERACIDS TO DISINFECT THE SAME ECOLAB INC (US) 2006-02-15 EP claimed
EP-1349912-B1 USE OF LOW FOAM PERCARBOXLIC ACID BASED PRODUCTS CONTAINING SURFACTANTS FOR CIP-DESINFECTION ECOLAB INC (US) 2005-03-02 EP claimed
US-20040146426-A1 Sterilization of surfaces ECOLAB USA INC. 2004-07-29 US claimed
US-20040053799-A1 Prevention of hoof infections in livestock breeding ECOLAB USA INC. 2004-03-18 US claimed
US-6693069-B2 COMBINATION OF PERACIDS AND A) AT LEAST ONE FATTY ACID AND/OR B) AT LEAST ONE HYDROTROPE AND/OR C) AT LEAST ONE SURFACTANT COMPONENT AND/OR D) AT LEAST ONE COMPLEXING COMPONENT ECOLAB GMBH & CO. OHG (DE) 2004-02-17 US claimed
US-20040029755-A1 Use of low foam percarboxylic acid based products containing surfactants for cip-disinfection ECOLAB USA INC. 2004-02-12 US claimed
US-20030139311-A1 Methods and agents for cleaning and disinfecting fragile medical appliances ECOLAB USA INC. 2003-07-24 US claimed
US-20030045443-A1 Washing of delicate textiles using peracids to disinfect the same ECOLAB USA INC. 2003-03-06 US claimed
EP-3931292-A1 STABILIZING SYSTEM FOR LAUNDRY EMULSIONS Ecolab USA Inc. (US) 2022-01-05 EP disclosed
US-11116215-B2 Aqueous antimicrobial film-forming composition for teat treatment by spray application ECOLAB USA INC. (US) 2021-09-14 US disclosed
EP-3221437-B1 LIQUID DETERGENT COMPOSITIONS ECOLAB USA INC (US) 2021-04-28 EP disclosed
US-6693069-B2 COMBINATION OF PERACIDS AND A) AT LEAST ONE FATTY ACID AND/OR B) AT LEAST ONE HYDROTROPE AND/OR C) AT LEAST ONE SURFACTANT COMPONENT AND/OR D) AT LEAST ONE COMPLEXING COMPONENT ECOLAB GMBH & CO. OHG (DE) 2004-02-17 US disclosed
US-20040029755-A1 Use of low foam percarboxylic acid based products containing surfactants for cip-disinfection ECOLAB USA INC. 2004-02-12 US disclosed
US-20030139311-A1 Methods and agents for cleaning and disinfecting fragile medical appliances ECOLAB USA INC. 2003-07-24 US disclosed
US-20030045443-A1 Washing of delicate textiles using peracids to disinfect the same ECOLAB USA INC. 2003-03-06 US disclosed