SCHEMBL4113451

SCHEMBL4113451

O=C(O)C[C@H]1CC2(CCN(C(=O)OC3C4CC5CC(C4)CC3C5)CC2)c2ccccc21

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.71
HSD11B2 P80365 3/20 0.71

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
SCHEMBL1222267 1.00 HSD11B1 (0.71) HSD11B1HSD11B2
SCHEMBL12884724 0.91 HSD11B1 (0.59) HSD11B1HSD11B2
SCHEMBL1223443 0.89 HSD11B1 (0.59) HSD11B1HSD11B2
SCHEMBL1223221 0.89 HSD11B1 (0.56) HSD11B1HSD11B2
SCHEMBL1222997 0.89 HSD11B1 (0.58) HSD11B1HSD11B2
SCHEMBL1222532 0.89 HSD11B1 (0.73) HSD11B1HSD11B2
SCHEMBL1223204 0.88 HSD11B1 (0.58) HSD11B1HSD11B2
SCHEMBL1222106 0.87 HSD11B1 (0.73) HSD11B1HSD11B2
SCHEMBL14293699 0.85 HSD11B1 (0.56) HSD11B1HSD11B2
SCHEMBL1222070 0.85 HSD11B1 (0.72) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2064187-A2 INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 Vitae Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
WO-2008024497-A2 INHIBITORS OF 11β -HYDROXYSTEROID DEHYDROGENASE TYPE 1 VITAE PHARMACEUTICALS, INC. (US) 2008-02-28 WO disclosed