SCHEMBL5598482

SCHEMBL5598482

CC(C)CN1CCCCC1(C)CC=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.33

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
SCHEMBL21618584 0.75 CYP2D6 (0.33) HSD11B1
SCHEMBL12039769 0.73 HSD11B1 (0.36) HSD11B1
SCHEMBL1555235 0.72 HSD11B1 (0.35) HSD11B1
SCHEMBL24554753 0.72 HSD11B1 (0.35) HSD11B1
SCHEMBL21618645 0.69 HSD11B1 (0.37) HSD11B1
SCHEMBL20803862 0.69 HSD11B1 (0.38) HSD11B1
SCHEMBL12546726 0.67
SCHEMBL26050253 0.67 HSD11B1 (0.32) HSD11B1
SCHEMBL24841889 0.66 HSD11B1 (0.39) HSD11B1
SCHEMBL24107346 0.66 PDCD1 (0.36) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007076104-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2007-07-05 WO disclosed