SCHEMBL16063072

SCHEMBL16063072

CC(=O)OC1OC(COC(=O)c2ccccc2)(C(C)(C)C)C(OC(=O)c2ccccc2)C1F

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 20/20 0.40

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
SCHEMBL17359828 0.92 ABCB1 (0.40) ABCB1
SCHEMBL16063065 0.90 MAPK1 (0.35) ABCB1
SCHEMBL16063060 0.84 ABCB1 (0.44) ABCB1
SCHEMBL16063064 0.81 ABCB1 (0.37) ABCB1
SCHEMBL17359605 0.79 ABCB1 (0.41) ABCB1
SCHEMBL16063070 0.75 ALDH1A1 (0.51) ABCB1
SCHEMBL3975101 0.75 ABCB1 (0.42) ABCB1
SCHEMBL25398613 0.74 MAPT (0.41) ABCB1
SCHEMBL6098791 0.74 ABCB1 (0.48) ABCB1
SCHEMBL6098831 0.74 ABCB1 (0.43) ABCB1

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-8835615-B2 2′-fluorine-4′-substituted-nucleoside analogues, preparation methods and uses thereof HENAN GENUINE BIOTECH CO., LTD. (CN) 2014-09-16 — — US disclosed
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