SCHEMBL10682128

SCHEMBL10682128

CCCOCC(C)(C)C(=O)OC

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.35
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
LMNA P02545 1/20 0.31
THRB P10828 1/20 0.31
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL13080893 0.88 TSHR (0.40) HSD17B10ALDH1A1CA1CA2TSHR
SCHEMBL13391772 0.85 ALDH1A1 (0.43) DGAT1ALDH1A1THRBTSHR
SCHEMBL17574066 0.84 DGAT1 (0.42) DGAT1HSD17B10ALDH1A1TSHR
SCHEMBL355529 0.83 TSHR (0.38) DGAT1ALDH1A1THRBTSHRMAPK1
SCHEMBL2183590 0.83 DGAT1 (0.35) DGAT1ALDH1A1THRBTSHR
SCHEMBL1691335 0.82 DGAT1 (0.38) DGAT1ALDH1A1THRBTSHR
SCHEMBL16869153 0.81 DGAT1 (0.34) DGAT1CA2THRBTSHR
SCHEMBL27265814 0.81 DGAT1 (0.34) DGAT1
SCHEMBL356764 0.81 DGAT1 (0.34) DGAT1
SCHEMBL30805232 0.79 CYP4A11 (0.41) DGAT1TSHR

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-4775692-A ANTILIPEMIC, ANTICOAGULANT, HYPOTENSIVE, ANTISECRETORY AND ANTIULCER AGENT TORAY INDUSTRIES, INC. (JP) 1988-10-04 US disclosed