SCHEMBL5679462

SCHEMBL5679462

CCCCCCCCC(=O)NCCCCCC(=O)C1=CC=CCC1=O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.48
FAAH O00519 4/20 0.47
NAAA Q02083 1/20 0.46
DNM1 Q05193 2/20 0.45
EPHX2 P34913 3/20 0.44
SLC6A5 Q9Y345 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.42
PRCP P42785 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
SCHEMBL8622265 1.00 CASP2 (0.48) CASP2FAAHNAAADNM1EPHX2
SCHEMBL8628675 1.00 CASP2 (0.48) CASP2FAAHNAAADNM1EPHX2
SCHEMBL42670 0.88 HSD17B3 (0.42) ALDH1A1
Sulfuric Acid SCHEMBL7029861 0.81 HSD17B3 (0.37) ALDH1A1
SCHEMBL6550421 0.78 NAAA (0.52) NAAAALDH1A1
SCHEMBL23775006 0.74 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL21633848 0.74 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL22271678 0.74 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL21234011 0.74 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL20542645 0.74 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1228190-B1 BLEACH-CONTAINING DETERGENT TABLETS PROCTER & GAMBLE (US) 2006-03-01 EP disclosed
EP-1412468-A1 DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2004-04-28 EP disclosed
EP-1337615-A2 DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2003-08-27 EP disclosed
WO-2003014286-A1 DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2003-02-20 WO disclosed
EP-1228190-A1 BLEACH-CONTAINING DETERGENT TABLETS THE PROCTER & GAMBLE COMPANY (US) 2002-08-07 EP disclosed
WO-2002042398-A2 DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2002-05-30 WO disclosed
WO-2001034759-A1 BLEACH-CONTAINING DETERGENT TABLETS THE PROCTER & GAMBLE COMPANY (US) 2001-05-17 WO disclosed