SCHEMBL17469690

SCHEMBL17469690

CCOC(=O)C(C)(C)OS(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.42
CYP4A11 Q02928 3/20 0.42
PPARA Q07869 2/20 0.42
ABCB11 O95342 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
HTR2A P28223 1/20 0.42
PMP22 Q01453 1/20 0.42
ALDH1A1 P00352 2/20 0.37
PKM P14618 3/20 0.37
MMP8 P22894 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
THRB P10828 1/20 0.35
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34

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
SCHEMBL17469691 0.84 HCAR2 (0.33) CYP4F2CYP4A11PPARAABCB11CYP1A2
SCHEMBL15858631 0.83 CYP4F2 (0.42) CYP4F2CYP4A11PPARAABCB11CYP1A2
SCHEMBL2598073 0.83 CYP4F2 (0.42) CYP4F2CYP4A11PPARAABCB11CYP1A2
SCHEMBL17469693 0.81 ALDH1A1 (0.44) CYP4F2CYP4A11CYP1A2TSHRALDH1A1
SCHEMBL11979568 0.79 CYP4F2 (0.42) CYP4F2CYP4A11PPARAABCB11CYP1A2
SCHEMBL11204992 0.76 HTT (0.40) CYP4F2CYP4A11TSHRALDH1A1PKM
SCHEMBL17469689 0.76 DGAT1 (0.38) KMT2ALMNA
SCHEMBL13232097 0.74 CYP4F2 (0.41) CYP4F2CYP4A11PPARAABCB11CYP1A2
SCHEMBL10825828 0.73 KMT2A (0.35) CYP4F2CYP4A11TSHRALDH1A1PKM
SCHEMBL445726 0.73 CYP4F2 (0.47) CYP4F2CYP4A11PPARAABCB11CYP1A2

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-20160027592-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2016-01-28 US disclosed