SCHEMBL1983418

SCHEMBL1983418

O=C(O)C[C@@]1(c2ccc(C(=O)N[C@H]3C4CC5CC3C[C@@](O)(C5)C4)c(C3CC3)n2)CCCNC1

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.59

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
SCHEMBL1973706 0.91 HSD11B1 (0.46) HSD11B1
SCHEMBL1973698 0.85 IDH1 (0.58) HSD11B1
SCHEMBL1969928 0.83 HSD11B1 (0.64) HSD11B1
SCHEMBL1968609 0.83 HSD11B1 (0.57) HSD11B1
SCHEMBL1970985 0.83 HSD11B1 (0.49) HSD11B1
SCHEMBL1977517 0.82 HSD11B1 (0.52) HSD11B1
SCHEMBL1973459 0.81 IDH1 (0.60) HSD11B1
SCHEMBL4455215 0.81 HSD11B1 (0.39) HSD11B1
SCHEMBL1970951 0.81 IDH1 (0.59) HSD11B1
SCHEMBL1970743 0.81 IDH1 (0.59) 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 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