SCHEMBL1584053

SCHEMBL1584053

CC(C)(C)NCCN(C(=O)O)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
MEN1 O00255 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GAA P10253 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
SCHEMBL17849000 0.83 MEN1 (0.37) MEN1HTTKMT2AL3MBTL1
SCHEMBL2721332 0.81 PRMT3 (0.37) MEN1HTTKMT2AL3MBTL1
SCHEMBL19210479 0.79 CYP2D6 (0.32) MEN1HTTKMT2AL3MBTL1
Hydrochloric Acid SCHEMBL837377 0.79 KDM4A (0.36) MEN1HTTKMT2AL3MBTL1
Hydrochloric Acid SCHEMBL26105931 0.78 ALOX15 (0.36) MEN1HTTKMT2AL3MBTL1
SCHEMBL19921253 0.77 POLB (0.36) POLBMEN1KMT2AGAA
SCHEMBL22771007 0.76 PAOX (0.37) MEN1HTTKMT2AL3MBTL1
SCHEMBL16412180 0.75 KDM4E (0.34) MEN1KMT2A
SCHEMBL930036 0.75 KDM4D (0.34) POLBKMT2A
SCHEMBL19820264 0.73

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
WO-2011041713-A2 PIPERAZINYL ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2011-04-07 WO disclosed