SCHEMBL8055340

SCHEMBL8055340

CC(C)(C)c1ccc(CO)c(CO[SiH](c2ccccc2)c2ccccc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.40
KLF10 Q13118 1/20 0.36
TSHR P16473 1/20 0.34
MAOB P27338 1/20 0.34
CYP2C19 P33261 2/20 0.33
CYP1A2 P05177 1/20 0.33
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 1/20 0.32
KIF11 P52732 2/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NR4A1 P22736 1/20 0.31
NR4A2 P43354 1/20 0.31

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
SCHEMBL9347229 0.84 CYP2D6 (0.54) CYP2D6KLF10TSHRMAOBCYP2C19
SCHEMBL9701313 0.82 CYP2D6 (0.35) CYP2D6MAOBCYP2C19CYP1A2KIF11
SCHEMBL8849619 0.82 CYP2D6 (0.38) CYP2D6TSHRMAOBCYP2C19CYP1A2
SCHEMBL9347249 0.81 CYP2D6 (0.37) CYP2D6TSHRMAOBRAB9AALDH1A1
SCHEMBL7499812 0.79 CYP2D6 (0.32) CYP2D6
SCHEMBL7498972 0.78 CYP2D6 (0.32) CYP2D6TSHR
SCHEMBL7505966 0.78 ADRB2 (0.34) CYP2D6MAOBCYP2C19RAB9A
SCHEMBL9343298 0.77 CYP2C19 (0.54) CYP2C19RXRARXRBRXRGMRGPRX4
SCHEMBL7488075 0.77 CYP2D6 (0.38) CYP2D6TSHRRXRARXRB
SCHEMBL9472706 0.76 CYP2D6 (0.33) CYP2D6RAB9AALDH1A1

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
EP-0739349-B1 POLYMER-SUPPORTED SOLUTION SYNTHESIS OF OLIGOSACCHARIDES INNOVATIONS FOUNDATION (CA) 2000-05-17 EP disclosed
US-5616698-A Polymer-supported solution synthesis of oligosaccharides UNIVERSITY OF TORONTO INNOVATIONS FOUNDATION (CA) 1997-04-01 US disclosed
EP-0739349-A1 POLYMER-SUPPORTED SOLUTION SYNTHESIS OF OLIGOSACCHARIDES INNOVATIONS FOUNDATION (CA) 1996-10-30 EP disclosed
WO-1995018814-A2 POLYMER-SUPPORTED SOLUTION SYNTHESIS OF OLIGOSACCHARIDES INNOVATIONS FOUNDATION (CA) 1995-07-13 WO disclosed