SCHEMBL2823055

SCHEMBL2823055

CC(C)(Oc1ccc(Cl)cc1Cl)/C(=N\C#N)NC1C2CC3CC1CC(S(N)(=O)=O)(C3)C2

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.63
HSD11B2 P80365 16/20 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
SCHEMBL2823056 1.00 HSD11B1 (0.63) HSD11B1HSD11B2
SCHEMBL2821760 0.92 HSD11B1 (0.62) HSD11B1HSD11B2
SCHEMBL2821761 0.92 HSD11B1 (0.62) HSD11B1HSD11B2
SCHEMBL2824420 0.92 HSD11B1 (0.62) HSD11B1HSD11B2
SCHEMBL2824418 0.92 HSD11B1 (0.62) HSD11B1HSD11B2
SCHEMBL2823843 0.92 HSD11B1 (0.76) HSD11B1HSD11B2
SCHEMBL2823845 0.92 HSD11B1 (0.76) HSD11B1HSD11B2
SCHEMBL2823109 0.92 HSD11B1 (0.64) HSD11B1HSD11B2
SCHEMBL2823104 0.92 HSD11B1 (0.64) HSD11B1HSD11B2
SCHEMBL2827228 0.90 HSD11B1 (0.74) 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