SCHEMBL3406000

SCHEMBL3406000

CC(C)(C)OC(=O)N1CC(OCCC2CCN(Cc3ccccc3)CC2)C1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 5/20 0.54
ACHE P22303 6/20 0.49
BCHE P06276 2/20 0.49
PRMT5 O14744 1/20 0.47
WDR77 Q9BQA1 1/20 0.47
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47

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
SCHEMBL23250043 0.85 SMN1; SMN2 (0.52) CHRM4KDM4EPKM
SCHEMBL8060432 0.83 JAK2 (0.58) CHRM4ACHEBCHEKDM4EPKM
SCHEMBL8056077 0.83 JAK2 (0.58) CHRM4ACHEBCHEKDM4EPKM
SCHEMBL8056082 0.83 JAK2 (0.58) CHRM4ACHEBCHEKDM4EPKM
SCHEMBL4470679 0.83 JAK2 (0.58) CHRM4ACHEBCHEKDM4EPKM
SCHEMBL29201760 0.83 CHRM4 (0.60) CHRM4KDM4EPKM
SCHEMBL22906774 0.83 PRMT5 (0.44) PRMT5WDR77KDM4EPKM
SCHEMBL8478310 0.82 GPR119 (0.57) CHRM4ACHEBCHEPRMT5WDR77
SCHEMBL18497603 0.81 KDM4E (0.57) CHRM4ACHEBCHEKDM4EPKM
SCHEMBL2246296 0.81 GPR119 (0.54) BCHEPRMT5WDR77

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
EP-2252613-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM, LLC (BM) 2010-11-24 EP disclosed
WO-2009105717-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2009-08-27 WO disclosed