SCHEMBL1968001

SCHEMBL1968001

CCCSc1nc(N2CCC(CC(=O)OC)C2)ccc1C(=O)NC1C2CC3CC1CC(O)(C3)C2

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 14/20 0.72
IDH1 O75874 5/20 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
SCHEMBL1967998 1.00 HSD11B1 (0.72) HSD11B1IDH1
SCHEMBL12571510 1.00 HSD11B1 (0.72) HSD11B1IDH1
SCHEMBL2008279 1.00 HSD11B1 (0.72) HSD11B1IDH1
SCHEMBL14972744 0.96 HSD11B1 (0.79) HSD11B1IDH1
SCHEMBL12571503 0.96 HSD11B1 (0.79) HSD11B1IDH1
SCHEMBL1968653 0.96 HSD11B1 (0.79) HSD11B1IDH1
SCHEMBL2012371 0.96 HSD11B1 (0.79) HSD11B1IDH1
SCHEMBL4457993 0.93 HSD11B1 (0.80) HSD11B1IDH1
SCHEMBL4461153 0.93 HSD11B1 (0.80) HSD11B1IDH1
SCHEMBL12571155 0.93 HSD11B1 (0.80) HSD11B1IDH1

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-2086939-B8 PYRIDINE CARBOXAMIDES AS 11-BETA-HSD1 INHIBITORS ASTRAZENECA AB (SE) 2011-06-22 EP disclosed
EP-2086939-A2 PYRIDINE CARBOXAMIDES AS 11-BETA-HSD1 INHIBITORS AstraZeneca AB (SE) 2009-08-12 EP disclosed
WO-2008053194-A2 PYRIDINE CARBOXAMIDES AS 11-BETA-HSD1 INHIBITORS ASTRAZENECA AB (SE) 2008-05-08 WO disclosed