SCHEMBL15537671

SCHEMBL15537671

CCC(CCCO)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 2/20 0.46
ALDH1A1 P00352 6/20 0.42
POLB P06746 2/20 0.42
KDM4E B2RXH2 2/20 0.42
TP53 P04637 2/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2D6 P10635 2/20 0.42
HPGD P15428 2/20 0.42
ALOX12 P18054 2/20 0.42
NFKB1 P19838 2/20 0.42
MAPK1 P28482 2/20 0.42
HSD17B10 Q99714 2/20 0.42
GLA P06280 1/20 0.42
APEX1 P27695 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
LMNA P02545 2/20 0.41
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
S100A4 P26447 2/20 0.38
CDC25A P30304 2/20 0.38

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
SCHEMBL14479254 0.87 TDP1 (0.44) ALDH1A1POLBKDM4ETP53CYP3A4
SCHEMBL30801194 0.84 NR1H2 (0.47) ALDH1A1TDP1GAAL3MBTL1CDC25A
SCHEMBL30678693 0.84 NR1H2 (0.47) ALDH1A1TDP1GAAL3MBTL1CDC25A
SCHEMBL9635500 0.84 ALDH1A1 (0.42) TNFALDH1A1POLBKDM4ETP53
SCHEMBL15241103 0.83 TDP1 (0.46) TNFALDH1A1POLBKDM4ETP53
SCHEMBL7054656 0.83 TDP1 (0.46) TNFALDH1A1POLBKDM4ETP53
SCHEMBL15240556 0.83 TDP1 (0.46) TNFALDH1A1POLBKDM4ETP53
SCHEMBL6364898 0.82 TDP1 (0.52) TNFALDH1A1POLBKDM4ETP53
SCHEMBL29740522 0.80 TDP1 (0.56) TNFALDH1A1POLBKDM4ETP53
SCHEMBL5277177 0.80 TDP1 (0.56) TNFALDH1A1POLBKDM4ETP53

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
EP-2855653-B1 STABILIZATION OF PHTHALIMIDO PERCARBOXYLIC WITH LITHIUM SALTS ECOLAB USA INC (US) 2016-07-20 EP disclosed
EP-2855653-A1 STABILIZATION OF PHTHALIMIDO PERCARBOXYLIC WITH LITHIUM SALTS Ecolab USA Inc. (US) 2015-04-08 EP disclosed
EP-2855654-A1 STABILIZATION OF PHTHALIMIDO PERCARBOXYLIC ACIDS WITH DISACCHARIDES Ecolab USA Inc. (US) 2015-04-08 EP disclosed
WO-2013178290-A1 STABILIZATION OF PHTHALIMIDO PERCARBOXYLIC ACIDS WITH DISACCHARIDES ECOLAB USA INC. (US) 2013-12-05 WO disclosed
WO-2013178289-A1 STABILIZATION OF PHTHALIMIDO PERCARBOXYLIC WITH LITHIUM SALTS ECOLAB USA INC. (US) 2013-12-05 WO disclosed