SCHEMBL3283265

SCHEMBL3283265

C=CC(=O)N(C)NCCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 3/20 0.47
ZDHHC2 Q9UIJ5 2/20 0.47
TSHR P16473 2/20 0.37
HPGD P15428 1/20 0.37
EPHX1 P07099 4/20 0.35
ALOX15 P16050 1/20 0.35
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH7 P40394 1/20 0.34
FAAH O00519 2/20 0.33
ALDH1A1 P00352 2/20 0.33
ACHE P22303 1/20 0.33
MMP2 P08253 1/20 0.33
DNM1 Q05193 1/20 0.33
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32

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
SCHEMBL3279966 0.94 ZDHHC20 (0.55) ZDHHC20ZDHHC2TSHRHPGDEPHX1
SCHEMBL3278295 0.93 ZDHHC20 (0.58) ZDHHC20ZDHHC2EPHX1ADH1BADH1C
SCHEMBL3279675 0.88 ZDHHC20 (0.41) ZDHHC20ZDHHC2TSHRHPGDADH1B
SCHEMBL3281047 0.79
SCHEMBL3278930 0.79 ZDHHC20 (0.42) ZDHHC20ZDHHC2TSHRHPGDEPHX1
SCHEMBL3279722 0.78 ZDHHC20 (0.41) ZDHHC20ZDHHC2TSHRHPGDEPHX1
SCHEMBL3286094 0.78 ZDHHC20 (0.41) ZDHHC20ZDHHC2TSHRHPGDEPHX1
Trimethylammonium SCHEMBL688148 0.74 ZDHHC20 (0.75) ZDHHC20ZDHHC2TSHREPHX1ALDH1A1
SCHEMBL3278186 0.74 ZDHHC20 (0.49) ZDHHC20ZDHHC2TSHRHPGDEPHX1
SCHEMBL3282863 0.73 EPHX1 (0.35) ZDHHC20ZDHHC2TSHREPHX1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700540-B2 Hard surface cleaning composition THE CLOROX COMPANY (US) 2010-04-20 US claimed
US-20070099816-A1 Hard Surface Cleaning Composition THE CLOROX COMPANY 2007-05-03 US claimed
US-7700540-B2 Hard surface cleaning composition THE CLOROX COMPANY (US) 2010-04-20 US disclosed
US-20070099816-A1 Hard Surface Cleaning Composition THE CLOROX COMPANY 2007-05-03 US disclosed