SCHEMBL3401955

SCHEMBL3401955

CCCSc1nc(NCC2CCC(C)(C(=O)O)CC2)ccc1C(=O)NC1CCCCC1

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.76

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
SCHEMBL13182824 0.90 HSD11B1 (0.85) HSD11B1
SCHEMBL1971515 0.86 HSD11B1 (1.00) HSD11B1
SCHEMBL12571009 0.86 HSD11B1 (1.00) HSD11B1
SCHEMBL14972863 0.84 HSD11B1 (0.79) HSD11B1
SCHEMBL2008865 0.83 HSD11B1 (0.83) HSD11B1
SCHEMBL12571587 0.83 HSD11B1 (0.83) HSD11B1
SCHEMBL3237306 0.83 HSD11B1 (0.84) HSD11B1
SCHEMBL2007008 0.81 HSD11B1 (1.00) HSD11B1
SCHEMBL2004950 0.80 HSD11B1 (0.75) HSD11B1
SCHEMBL2003532 0.77 HSD11B1 (0.71) HSD11B1

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-2233480-A1 Chemical compounds AstraZeneca AB (SE) 2010-09-29 EP disclosed