SCHEMBL13286223

SCHEMBL13286223

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

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
TRPA1 O75762 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
SCHEMBL536613 0.86 GAA (0.46) GAA
SCHEMBL503237 0.81
SCHEMBL10456471 0.81 GAA (0.50) GAA
SCHEMBL16254850 0.80 GAA (0.41) GAA
SCHEMBL726281 0.80 GAA (0.41) GAA
SCHEMBL24992192 0.78 GAA (0.40) GAA
SCHEMBL10046620 0.77 GAA (0.43) GAA
SCHEMBL43112 0.77 GAA (0.46) GAA
SCHEMBL9465473 0.75 GAA (0.44) GAA
SCHEMBL17166970 0.74 GAA (0.40) GAA

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
WO-2010083403-A1 FUSED AMINO PYRIDINES FOR THE TREATMENT OF BRAIN TUMORS CURIS, INC. (US) 2010-07-22 WO disclosed
WO-2008115719-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS, INC. (US) 2008-09-25 WO disclosed