SCHEMBL2826749

SCHEMBL2826749

NC(=O)C12CC3CC(C1)C(NC(=O)O)C(C3)C2

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.56
HSD11B2 P80365 3/20 0.54

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
SCHEMBL14680727 0.80 HSD11B1 (0.61) HSD11B1HSD11B2
SCHEMBL3120761 0.79 HSD11B1 (0.49) HSD11B1HSD11B2
SCHEMBL9948724 0.79 THRB (0.48) HSD11B1HSD11B2
SCHEMBL231523 0.79 HSD11B1 (0.54) HSD11B1HSD11B2
SCHEMBL232999 0.79 HSD11B1 (0.63) HSD11B1HSD11B2
SCHEMBL2444996 0.77 HSD11B1 (0.58) HSD11B1HSD11B2
SCHEMBL16684462 0.77 HSD11B1 (0.60) HSD11B1
SCHEMBL16684409 0.77 HSD11B1 (0.59) HSD11B1
SCHEMBL2453597 0.77 HSD11B1 (0.58) HSD11B1HSD11B2
SCHEMBL3041989 0.77 HSD11B1 (0.54) HSD11B1HSD11B2

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-2243479-A2 Novel amide and amidine derivates and uses thereof Abbott Laboratories (US) 2010-10-27 EP disclosed