SCHEMBL2824715

SCHEMBL2824715

CC(C)(Oc1ccccc1C(F)(F)F)C(=NC1C2CC3CC1CC(S(N)(=O)=O)(C3)C2)NC#N

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.53
HSD11B2 P80365 12/20 0.53

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
SCHEMBL2827183 0.92 HSD11B1 (0.63) HSD11B1HSD11B2
SCHEMBL2824692 0.92 HSD11B1 (0.63) HSD11B1HSD11B2
SCHEMBL2827114 0.91 HSD11B1 (0.51) HSD11B1HSD11B2
SCHEMBL2822509 0.90 HSD11B1 (0.52) HSD11B1HSD11B2
SCHEMBL2823618 0.90 HSD11B1 (0.50) HSD11B1HSD11B2
SCHEMBL2827232 0.89 HSD11B1 (0.63) HSD11B1HSD11B2
SCHEMBL2823565 0.86 HSD11B1 (0.53) HSD11B1HSD11B2
SCHEMBL2825188 0.85 HSD11B1 (0.50) HSD11B1HSD11B2
SCHEMBL2824487 0.85 HSD11B1 (0.53) HSD11B1HSD11B2
SCHEMBL2830496 0.84 HSD11B1 (0.52) 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 1 patent. 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 disclosed