SCHEMBL3018816

SCHEMBL3018816

CC(OS(C)(=O)=O)c1nccn1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
KMT2A Q03164 2/20 0.36
CYP2D6 P10635 1/20 0.35
ALDH1A1 P00352 3/20 0.34
LPO P22079 1/20 0.34
MAPT P10636 2/20 0.34
TSHR P16473 2/20 0.34
ALOX15 P16050 2/20 0.34
HSD17B10 Q99714 2/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
PKM P14618 1/20 0.34
ALOX12 P18054 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNA4 P43681 1/20 0.33
MEN1 O00255 1/20 0.33
FGB P02675 1/20 0.33
TNNI3 P19429 1/20 0.33

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
SCHEMBL3016928 0.81 KMT2A (0.44) KDM4EL3MBTL1KMT2ACYP2D6ALDH1A1
SCHEMBL27713110 0.80 KDM4E (0.41) KDM4EL3MBTL1KMT2ACYP2D6ALDH1A1
SCHEMBL372498 0.76 KDM4E (0.44) KDM4EL3MBTL1KMT2ACYP2D6ALDH1A1
Hydrochloric Acid SCHEMBL28772143 0.74 KDM4E (0.43) KDM4EL3MBTL1KMT2ACYP2D6ALDH1A1
Bromide SCHEMBL28152662 0.74 KDM4E (0.43) KDM4EL3MBTL1KMT2ACYP2D6ALDH1A1
SCHEMBL2998187 0.74 KMT2A (0.46) KDM4EL3MBTL1KMT2ACYP2D6ALDH1A1
SCHEMBL27774303 0.74 KDM4E (0.47) KDM4EL3MBTL1KMT2ACYP2D6ALDH1A1
SCHEMBL3014365 0.72 KMT2A (0.45) KDM4EL3MBTL1KMT2ACYP2D6ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL16699953 0.72 KMT2A (0.42) KDM4EL3MBTL1KMT2ACYP2D6ALDH1A1
SCHEMBL16700625 0.71 L3MBTL1 (0.49) KDM4EL3MBTL1KMT2ACYP2D6ALDH1A1

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-8362095-B2 Defoaming of ionic liquids EVONIK GOLDSCHMIDT GMBH (DE) 2013-01-29 US disclosed
US-20100192814-A1 PROCESS FOR PRODUCING ANTISTATICALLY TREATED ARTIFICIAL STONE FOR FLAT STRUCTURES EVONIK GOLDSCHMIDT GMBH (DE) 2010-08-05 US disclosed
US-20100084597-A1 DEFOAMING OF IONIC LIQUIDS EVONIK DEGUSSA GMBH (DE) 2010-04-08 US disclosed
US-20100029519-A1 PERFORMANCE ADDITIVES FOR IMPROVING THE WETTING PROPERTIES OF IONIC LIQUIDS ON SOLID SURFACES EVONIK DEGUSSA GMBH (DE) 2010-02-04 US disclosed