SCHEMBL13178384

SCHEMBL13178384

C[C@H]1CC(=O)N([C@@H](C)CO)C1=O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.43
PIK3CD O00329 1/20 0.33
BRD4 O60885 2/20 0.32
POLB P06746 1/20 0.30
MAPT P10636 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
SCHEMBL15040816 1.00 MME (0.43) MMEPIK3CDBRD4POLBMAPT
SCHEMBL2931296 1.00 MME (0.43) MMEPIK3CDBRD4POLBMAPT
SCHEMBL12418611 0.83 MME (0.36) MMEPIK3CDBRD4POLBMAPT
SCHEMBL17532408 0.79 PIK3CD (0.35) MMEPIK3CD
SCHEMBL11912104 0.78 MAPT (0.41) MMEPIK3CDMAPT
SCHEMBL13802677 0.78 MAPT (0.41) MMEPIK3CDMAPT
SCHEMBL18570060 0.77 MME (0.35) MME
SCHEMBL24342080 0.76 MME (0.31) MMEPIK3CD
SCHEMBL21153268 0.75 MME (0.33) MMEPIK3CDMAPT
SCHEMBL13558663 0.74 MAPT (0.34) MMEPIK3CDMAPT

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-1501819-B1 ESTROGEN RECEPTOR MODULATORS MERCK SHARP & DOHME (US) 2010-09-15 EP disclosed