SCHEMBL3972548

SCHEMBL3972548

Nc1ccc(C2(C(=O)N3CCC4(C3)OC(=O)c3ccccc34)CC2)cc1

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 18/20 0.80
CYP2D6 P10635 1/20 0.80
POLB P06746 1/20 0.46
NPY5R Q15761 1/20 0.45

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
SCHEMBL350725 1.00 HSD11B1 (0.80) HSD11B1CYP2D6POLBNPY5R
SCHEMBL1321953 1.00 HSD11B1 (0.80) HSD11B1CYP2D6POLBNPY5R
SCHEMBL349561 0.90 HSD11B1 (0.82) HSD11B1CYP2D6NPY5R
SCHEMBL347562 0.89 HSD11B1 (1.00) HSD11B1CYP2D6
SCHEMBL349354 0.89 HSD11B1 (0.80) HSD11B1CYP2D6NPY5R
SCHEMBL350459 0.89 HSD11B1 (0.80) HSD11B1CYP2D6NPY5R
SCHEMBL350329 0.89 HSD11B1 (1.00) HSD11B1CYP2D6
SCHEMBL348468 0.89 HSD11B1 (0.80) HSD11B1CYP2D6NPY5R
SCHEMBL351623 0.87 HSD11B1 (0.74) HSD11B1CYP2D6NPY5R
SCHEMBL350038 0.87 HSD11B1 (0.74) HSD11B1CYP2D6NPY5R

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