SCHEMBL5016462

SCHEMBL5016462

CCCC1(C)SC(N(C)C2CCCCC2)=NC1=O

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 15/20 0.44
GAA P10253 1/20 0.31
JAK3 P52333 1/20 0.30

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
SCHEMBL5015319 0.90 HSD11B1 (0.43) HSD11B1GAAJAK3
SCHEMBL1605164 0.88 HSD11B1 (0.34) HSD11B1GAA
SCHEMBL1605602 0.84 HSD11B1 (0.33) HSD11B1
SCHEMBL21067297 0.74 HSD11B1 (0.42) HSD11B1
SCHEMBL5025303 0.74 HSD11B1 (0.42) HSD11B1
SCHEMBL1605949 0.74 HSD11B1 (0.42) HSD11B1
SCHEMBL5138688 0.74 HSD11B1 (0.42) HSD11B1
SCHEMBL5016463 0.72 HSD11B1 (0.44) HSD11B1
SCHEMBL1605493 0.70 MEN1 (0.33) GAAJAK3
SCHEMBL10249545 0.69 HSD11B1 (0.41) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753736-B1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AMGEN INC (US) 2008-12-17 EP disclosed
US-7253196-B2 Inhibitors of 11-β-hydroxy steroid dehydrogenase type 1 AMGEN, INC. (US) 2007-08-07 US disclosed