SCHEMBL1498623

SCHEMBL1498623

CCCCCCCCCC(=O)N(C)CCO

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.66
EPHX2 P34913 2/20 0.57
ALDH1A1 P00352 3/20 0.48
KDM5A P29375 1/20 0.47
KDM4C Q9H3R0 1/20 0.47
PHF8 Q9UPP1 1/20 0.47
DNM1 Q05193 1/20 0.47
CES2 O00748 3/20 0.46
CES1 P23141 3/20 0.46
CNR2 P34972 1/20 0.45
TRPV1 Q8NER1 1/20 0.45
PPARG P37231 6/20 0.45
PPARD Q03181 6/20 0.45
PPARA Q07869 6/20 0.45
GPR84 Q9NQS5 5/20 0.45
HDAC11 Q96DB2 5/20 0.45
TSHR P16473 4/20 0.45
TLR2 O60603 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
FABP4 P15090 2/20 0.45

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
SCHEMBL25702799 1.00 CNR1 (0.66) CNR1EPHX2ALDH1A1KDM5AKDM4C
SCHEMBL1982755 1.00 CNR1 (0.66) CNR1EPHX2ALDH1A1KDM5AKDM4C
SCHEMBL5195516 1.00 CNR1 (0.66) CNR1EPHX2ALDH1A1KDM5AKDM4C
SCHEMBL5192446 1.00 CNR1 (0.66) CNR1EPHX2ALDH1A1KDM5AKDM4C
SCHEMBL6852352 1.00 CNR1 (0.66) CNR1EPHX2ALDH1A1KDM5AKDM4C
SCHEMBL1498720 1.00 CNR1 (0.66) CNR1EPHX2ALDH1A1KDM5AKDM4C
Sulfuric Acid SCHEMBL31710598 0.93 CNR1 (0.59) CNR1EPHX2ALDH1A1KDM5AKDM4C
Sulfuric Acid SCHEMBL31710161 0.93 CNR1 (0.59) CNR1EPHX2ALDH1A1KDM5AKDM4C
SCHEMBL20725634 0.92 CNR1 (0.54) CNR1EPHX2ALDH1A1KDM5AKDM4C
SCHEMBL822981 0.92 CNR1 (0.54) CNR1EPHX2ALDH1A1KDM5AKDM4C

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
WO-2011032924-A1 ANTIMICROBIAL 2-HYDROXYETHYL AMIDE EVONIK GOLDSCHMIDT GMBH (DE) 2011-03-24 WO disclosed
CN-100372919-C Surfactant composition KAO CORP (JP) 2008-03-05 CN disclosed
CN-1215159-C Surfactant composition KAO CORP (JP) 2005-08-17 CN disclosed
CN-1377947-A Surfactant composition KAO CORP (JP) 2002-11-06 CN disclosed
CN-1339059-A Surfactant composition KAO CORP (JP) 2002-03-06 CN disclosed