SCHEMBL3279675

SCHEMBL3279675

C=CC(=O)N(C)NCCC

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 2/20 0.41
ZDHHC2 Q9UIJ5 2/20 0.41
TSHR P16473 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 1/20 0.31
ADH1B P00325 1/20 0.30
ADH1A P07327 1/20 0.30
ADH7 P40394 1/20 0.30

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
SCHEMBL3283265 0.88 ZDHHC20 (0.47) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL3279966 0.86 ZDHHC20 (0.55) ZDHHC20ZDHHC2TSHRHPGDADH1B
SCHEMBL3278295 0.85 ZDHHC20 (0.58) ZDHHC20ZDHHC2ADH1BADH1AADH7
SCHEMBL3281047 0.83
SCHEMBL19649540 0.80 ZDHHC20 (0.35) ZDHHC20ZDHHC2TSHRALDH1A1
SCHEMBL3280461 0.78 ZDHHC20 (0.36) ZDHHC20ZDHHC2TSHRALDH1A1HPGD
SCHEMBL3279654 0.76 ZDHHC20 (0.36) ZDHHC20ZDHHC2TSHRALDH1A1HPGD
SCHEMBL3279668 0.73 ZDHHC20 (0.41) ZDHHC20ZDHHC2TSHRALDH1A1HPGD
Trimethylammonium SCHEMBL21701 0.72 ZDHHC20 (0.62) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Dimethylamine SCHEMBL4543917 0.72 ZDHHC20 (0.51) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1

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