SCHEMBL1968358

SCHEMBL1968358

CCCSc1nc(N2CCC(OCC(=O)O)C2)ccc1C(=O)NC1C2CC3CC(C2)CC1C3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 19/20 1.00
IDH1 O75874 1/20 0.52

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
SCHEMBL2010101 1.00 HSD11B1 (1.00) HSD11B1IDH1
SCHEMBL1968353 1.00 HSD11B1 (1.00) HSD11B1IDH1
SCHEMBL3404516 0.93 HSD11B1 (0.86) HSD11B1IDH1
SCHEMBL14972839 0.90 HSD11B1 (0.82) HSD11B1IDH1
SCHEMBL14972787 0.90 HSD11B1 (0.82) HSD11B1IDH1
SCHEMBL1972815 0.87 HSD11B1 (0.77) HSD11B1IDH1
SCHEMBL3404521 0.86 HSD11B1 (0.75) HSD11B1IDH1
SCHEMBL1968311 0.86 HSD11B1 (0.75) HSD11B1IDH1
SCHEMBL1969907 0.86 HSD11B1 (0.75) HSD11B1IDH1
SCHEMBL1968306 0.86 HSD11B1 (0.75) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2086939-A2 PYRIDINE CARBOXAMIDES AS 11-BETA-HSD1 INHIBITORS AstraZeneca AB (SE) 2009-08-12 EP claimed
WO-2008053194-A2 PYRIDINE CARBOXAMIDES AS 11-BETA-HSD1 INHIBITORS ASTRAZENECA AB (SE) 2008-05-08 WO claimed
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