SCHEMBL2826073

SCHEMBL2826073

CC(C)(/C(=N\C#N)NC1C2CC3CC1CC(C(=O)O)(C3)C2)N1CC2CC(c3ccc(Cl)cc3)C2C1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.49
HSD11B2 P80365 14/20 0.49

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
SCHEMBL2826076 1.00 HSD11B1 (0.49) HSD11B1HSD11B2
SCHEMBL2826078 1.00 HSD11B1 (0.49) HSD11B1HSD11B2
SCHEMBL2831269 0.92 HSD11B1 (0.42) HSD11B1HSD11B2
SCHEMBL2831272 0.88 HSD11B1 (0.36) HSD11B1HSD11B2
SCHEMBL2822804 0.87 HSD11B1 (0.59) HSD11B1HSD11B2
SCHEMBL2822810 0.87 HSD11B1 (0.59) HSD11B1HSD11B2
SCHEMBL2822886 0.85 HSD11B1 (0.52) HSD11B1HSD11B2
SCHEMBL2822882 0.85 HSD11B1 (0.52) HSD11B1HSD11B2
SCHEMBL2827139 0.84 HSD11B1 (0.51) HSD11B1HSD11B2
SCHEMBL2827137 0.84 HSD11B1 (0.51) 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-2243479-A2 Novel amide and amidine derivates and uses thereof Abbott Laboratories (US) 2010-10-27 EP claimed
EP-2243479-A2 Novel amide and amidine derivates and uses thereof Abbott Laboratories (US) 2010-10-27 EP disclosed