SCHEMBL3900679

SCHEMBL3900679

CC(=O)OC1(c2ccccc2)CCN(C(=O)C2(c3ccc(Cl)cc3)CC2)C1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.54
CYP2D6 P10635 1/20 0.51

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
SCHEMBL3900673 0.89 HSD11B1 (0.52) HSD11B1CYP2D6
SCHEMBL350029 0.84 HSD11B1 (0.51) HSD11B1CYP2D6
SCHEMBL350776 0.83 HSD11B1 (0.53) HSD11B1CYP2D6
SCHEMBL349076 0.78 HSD11B1 (0.61) HSD11B1CYP2D6
SCHEMBL350014 0.75 HSD11B1 (0.67) HSD11B1
SCHEMBL349846 0.74 HSD11B1 (0.78) HSD11B1CYP2D6
SCHEMBL7176061 0.72 DRD2 (0.52) HSD11B1
SCHEMBL349790 0.72 HSD11B1 (0.71) HSD11B1CYP2D6
SCHEMBL349352 0.71 HSD11B1 (0.60) HSD11B1
SCHEMBL351003 0.71 HSD11B1 (0.59) HSD11B1CYP2D6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756063-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-03-25 EP disclosed
EP-1756063-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-02-28 EP disclosed
WO-2005110992-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2005-11-24 WO disclosed