SCHEMBL4400600

SCHEMBL4400600

Cc1cc(Cl)ccc1OC(C)(C)C(=O)NC1[C@@H]2CC3C[C@H]1CC(S(=O)(=O)N(C)C)(C3)C2

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.75
HSD11B2 P80365 16/20 0.75

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
SCHEMBL1046451 0.86 HSD11B1 (1.00) HSD11B1HSD11B2
SCHEMBL14260960 0.86 HSD11B1 (0.59) HSD11B1HSD11B2
SCHEMBL14260940 0.86 HSD11B1 (0.58) HSD11B1HSD11B2
SCHEMBL4405580 0.86 HSD11B1 (0.58) HSD11B1HSD11B2
SCHEMBL4395893 0.85 HSD11B1 (0.60) HSD11B1HSD11B2
SCHEMBL14260942 0.85 HSD11B1 (0.60) HSD11B1HSD11B2
SCHEMBL4408678 0.84 HSD11B1 (0.61) HSD11B1HSD11B2
SCHEMBL14260932 0.84 HSD11B1 (0.61) HSD11B1HSD11B2
SCHEMBL14260969 0.83 HSD11B1 (0.74) HSD11B1HSD11B2
SCHEMBL4401468 0.83 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1796657-B1 N-2 ADAMANTANYL-2-PHENOXY-ACETAMIDE DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2009-12-23 EP claimed