SCHEMBL7739748

SCHEMBL7739748

CC(=O)OC1O[C@H](C)[C@H](OC(C)=O)[C@@H]1OC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OGA O60502 1/20 0.50
▸ CA9 Q16790 5/20 0.49
▸ CA2 P00918 5/20 0.49
▸ CA12 O43570 4/20 0.49
▸ CA1 P00915 3/20 0.49
▸ TSHR P16473 2/20 0.41
▸ CYP2D6 P10635 3/20 0.38
▸ THRB P10828 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ CYP3A4 P08684 5/20 0.38
▸ RPS6KA3 P51812 1/20 0.34
▸ RPS6KA1 Q15418 1/20 0.34
▸ P4HB P07237 1/20 0.32
▸ PDIA4 P13667 1/20 0.32
▸ PDIA3 P30101 1/20 0.32
▸ NR3C1 P04150 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ ADRA2A P08913 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.31
▸ ADRA2B P18089 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
SCHEMBL12302011 1.00 OGA (0.50) OGACA9CA2CA12CA1
SCHEMBL13080340 1.00 OGA (0.50) OGACA9CA2CA12CA1
SCHEMBL7739258 1.00 OGA (0.50) OGACA9CA2CA12CA1
SCHEMBL7739256 1.00 OGA (0.50) OGACA9CA2CA12CA1
SCHEMBL13133631 1.00 OGA (0.50) OGACA9CA2CA12CA1
SCHEMBL12330761 1.00 OGA (0.50) OGACA9CA2CA12CA1
SCHEMBL332549 1.00 OGA (0.50) OGACA9CA2CA12CA1
SCHEMBL14038566 1.00 OGA (0.50) OGACA9CA2CA12CA1
SCHEMBL2441166 1.00 OGA (0.50) OGACA9CA2CA12CA1
SCHEMBL332385 1.00 OGA (0.50) OGACA9CA2CA12CA1

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-6413938-B1 HERPES VIRUS THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2002-07-02 — — US disclosed
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