SCHEMBL9299187

SCHEMBL9299187

CC(=O)OC[C@H]1O[C@H](F)[C@H](F)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.55
▸ CYP2D6 P10635 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ TSHR P16473 1/20 0.54
▸ NR3C1 P04150 1/20 0.54
▸ FYN P06241 1/20 0.54
▸ ADRA2A P08913 1/20 0.54
▸ ADORA3 P0DMS8 1/20 0.54
▸ ADRA2B P18089 1/20 0.54
▸ DRD4 P21917 1/20 0.54
▸ DRD3 P35462 1/20 0.54
▸ CA2 P00918 11/20 0.52
▸ CA12 O43570 10/20 0.52
▸ CA1 P00915 10/20 0.52
▸ CA9 Q16790 8/20 0.52
▸ PKM P14618 1/20 0.48
▸ PTPN1 P18031 1/20 0.48
▸ CA4 P22748 4/20 0.46
▸ CA5A P35218 4/20 0.46
▸ CA7 P43166 4/20 0.46

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
SCHEMBL8824601 1.00 THRB (0.55) THRBCYP2D6HSD17B10TSHRNR3C1
SCHEMBL9299185 1.00 THRB (0.55) THRBCYP2D6HSD17B10TSHRNR3C1
SCHEMBL8824606 1.00 THRB (0.55) THRBCYP2D6HSD17B10TSHRNR3C1
SCHEMBL9299882 1.00 THRB (0.55) THRBCYP2D6HSD17B10TSHRNR3C1
SCHEMBL22659917 0.92 THRB (0.56) THRBCYP2D6HSD17B10TSHRNR3C1
SCHEMBL22659914 0.92 THRB (0.56) THRBCYP2D6HSD17B10TSHRNR3C1
SCHEMBL21021147 0.90 CYP2D6 (0.58) THRBCYP2D6HSD17B10TSHRNR3C1
SCHEMBL20820941 0.90 CYP2D6 (0.58) THRBCYP2D6HSD17B10TSHRNR3C1
SCHEMBL16731431 0.90 CYP2D6 (0.58) THRBCYP2D6HSD17B10TSHRNR3C1
SCHEMBL2215629 0.90 CYP2D6 (0.58) THRBCYP2D6HSD17B10TSHRNR3C1

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
US-5374746-A L-talopyranoside derivatives and process for the preparation of same DONG-A PHARMACEUTICAL CO., LTD. (KR) 1994-12-20 — — US disclosed
US-H74-H Process for the production of 18F-2-deoxy-2-fluoro-D-glucose THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY 1986-06-03 — — US disclosed
Send feedback