SCHEMBL6428754

SCHEMBL6428754

CCOc1cc2cc3ccccc3cc2c(OCC)c1S(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 4/20 0.42
TLR8 Q9NR97 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
IDO1 P14902 1/20 0.36
PDE10A Q9Y233 1/20 0.36
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.36
AHR P35869 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALOX5 P09917 1/20 0.35

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
SCHEMBL5365236 0.82 SLC2A1 (0.42) SLC2A1TLR8HSD17B10L3MBTL1GAA
SCHEMBL935476 0.79 TLR8 (0.45) SLC2A1TLR8HSD17B10L3MBTL1TDP1
SCHEMBL5950594 0.79 NQO1 (0.46) SLC2A1NPC1MEN1KMT2AKDM4E
SCHEMBL2492291 0.78 CYP2D6 (0.47) SLC2A1TLR8HSD17B10KDM4ETP53
SCHEMBL27603599 0.76 SLC2A1 (0.46) SLC2A1HSD17B10L3MBTL1TSHRKDM4E
SCHEMBL19019819 0.76 TLR8 (0.42) SLC2A1TLR8L3MBTL1TDP1NPC1
SCHEMBL4238902 0.73 NQO1 (0.46) SLC2A1NPC1KDM4ESMN1; SMN2ALOX5
Anthracene SCHEMBL10715579 0.73 ALOX5 (0.44) SLC2A1TLR8L3MBTL1GAAMAPK1
SCHEMBL754110 0.73 ALOX5 (0.44) SLC2A1TLR8L3MBTL1GAAMAPK1
SCHEMBL3178648 0.73 ALDH1A1 (0.49) SLC2A1HSD17B10L3MBTL1GAAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1595182-A2 HALOGENATED OXIME DERIVATIVES AND THE USE THEREOF AS LATENT ACIDS Ciba SC Holding AG (CH) 2005-11-16 EP disclosed
WO-2004074242-A2 HALOGENATED OXIME DERIVATIVES AND THE USE THEREOF AS LATENT ACIDS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-09-02 WO disclosed