SCHEMBL8319252

SCHEMBL8319252

CN(C)c1ccc([S+](c2ccc(O[Si](C)(C)C)cc2)c2ccc(O[Si](C)(C)C)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
TSHR P16473 3/20 0.41
HSD17B10 Q99714 2/20 0.41
ALOX15 P16050 2/20 0.41
MAPT P10636 5/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
SLC2A1 P11166 1/20 0.38
APP P05067 8/20 0.35
TP53 P04637 2/20 0.34
CYP3A4 P08684 2/20 0.34
MAPK1 P28482 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
CHRM5 P08912 1/20 0.34
CHKA P35790 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
ESR2 Q92731 1/20 0.33
NOX1 Q9Y5S8 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
SCHEMBL8326336 0.86
SCHEMBL8319054 0.84 ALDH1A1 (0.33) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL246007 0.79 ALDH1A1 (0.65) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL13131044 0.79 NPC1 (0.32) NPC1RAB9A
SCHEMBL13130986 0.79 NPC1 (0.32) NPC1RAB9A
Hydrochloric Acid SCHEMBL8630989 0.77 ALDH1A1 (0.61) ALDH1A1TSHRHSD17B10ALOX15MAPT
Hydrochloric Acid SCHEMBL8629167 0.77 ALDH1A1 (0.61) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL13130995 0.77 ESR2 (0.39) ALDH1A1HSD17B10ALOX15MAPTKDM4E
SCHEMBL248025 0.74 ALDH1A1 (0.41) ALDH1A1TSHRHSD17B10ALOX15MAPT
SCHEMBL8323353 0.74 ALDH1A1 (0.41) ALDH1A1TSHRHSD17B10ALOX15MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5880169-A HAVING HIGH RESOLUTION FOR FINE PATTERNING SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-03-09 US disclosed