SCHEMBL5217213

SCHEMBL5217213

COC(=O)C(C)(C)C(=O)CCBr

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.45
TSHR P16473 2/20 0.33
ELANE P08246 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
SCHEMBL3576946 0.82 DGAT1 (0.48) DGAT1TSHRELANE
SCHEMBL10567903 0.81 MEN1 (0.35)
SCHEMBL4463447 0.80 DGAT1 (0.46) DGAT1TSHRELANE
SCHEMBL3646518 0.77 DGAT1 (0.43) DGAT1
SCHEMBL10569449 0.75 TRPA1 (0.35) TSHR
SCHEMBL4463173 0.75 DGAT1 (0.50) DGAT1TSHRELANE
SCHEMBL16671511 0.74 FAAH (0.52) TSHR
SCHEMBL2313446 0.73 DGAT1 (0.48) DGAT1TSHRELANE
SCHEMBL808799 0.72 DGAT1 (0.74) DGAT1TSHRELANE
SCHEMBL7753978 0.71

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
EP-1480640-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2007-08-15 EP disclosed