SCHEMBL15445467

SCHEMBL15445467

CC(OC(=O)CC(=O)OC(C)(C)C)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.42
CA2 P00918 2/20 0.36
CA1 P00915 1/20 0.36
CA7 P43166 1/20 0.36
PTPRC P08575 2/20 0.33
CTSK P43235 2/20 0.33
DGAT1 O75907 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
CTSS P25774 1/20 0.31
CA12 O43570 2/20 0.31
CA14 Q9ULX7 2/20 0.31
APLNR P35414 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
SCHEMBL8912333 0.82 CYP2D6 (0.46) CYP2D6CA2CA1CA7CTSK
SCHEMBL241533 0.78 DGAT1 (0.46) CYP2D6CA2CA1CA7DGAT1
SCHEMBL14015831 0.78 MEN1 (0.34) MEN1KMT2A
Methyl Alcohol SCHEMBL27995686 0.76 DGAT1 (0.44) CYP2D6CA2CA1CA7DGAT1
SCHEMBL15445470 0.75 CYP2D6 (0.36) CYP2D6CA2CA1CA7PTPRC
SCHEMBL14015832 0.74 ALDH1A1 (0.43) CTSKHDAC3HDAC1HDAC2HDAC8
SCHEMBL27845434 0.74 CYP2D6 (0.41) CYP2D6CA2CA1CA7CTSK
SCHEMBL28316203 0.74 DGAT1 (0.42) CYP2D6CA2CA1CA7DGAT1
SCHEMBL29438012 0.72 DGAT1 (0.41) CYP2D6CA2CA1CA7DGAT1
SCHEMBL332199 0.72 GAA (0.48) CYP2D6CA2CA1CA7DGAT1

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-9250356-B2 Photochromic polymers VIVIMED LABS EUROPE LTD (GB) 2016-02-02 US disclosed
US-20140027684-A1 PHOTOCHROMIC POLYMERS VIVIMED LABS EUROPE LTD (GB) 2014-01-30 US disclosed