SCHEMBL3282863

SCHEMBL3282863

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

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 4/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 2/20 0.35
ACHE P22303 7/20 0.33
MMP2 P08253 1/20 0.33
ALDH1A1 P00352 1/20 0.33
DNM1 Q05193 2/20 0.33
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 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
SCHEMBL3279647 0.94 EPHX1 (0.39) EPHX1TSHRALDH1A1DNM1ZDHHC20
SCHEMBL3280161 0.93 EPHX1 (0.42) EPHX1TSHRDNM1ZDHHC20ZDHHC2
SCHEMBL3286159 0.88 PAOX (0.31) ALDH1A1
SCHEMBL3286239 0.79 ALDH1A1 (0.32) ALDH1A1
SCHEMBL3278872 0.79 EPHX1 (0.34) EPHX1ALOX15TSHRACHEMMP2
SCHEMBL3280474 0.78 EPHX1 (0.33) EPHX1ALOX15TSHRACHEMMP2
SCHEMBL3282446 0.78 TSHR (0.37) EPHX1ALOX15TSHRACHEMMP2
SCHEMBL3280674 0.74 EPHX1 (0.38) EPHX1TSHRALDH1A1ZDHHC20ZDHHC2
SCHEMBL3283265 0.73 ZDHHC20 (0.47) EPHX1ALOX15TSHRACHEMMP2
SCHEMBL3280872 0.73 TSHR (0.40) EPHX1TSHRALDH1A1DNM1ZDHHC20

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