SCHEMBL2523456

SCHEMBL2523456

CC(C)(C)N(C(=O)O)C1CCC(O)(CS)CC1

nearest known ligand 0.34

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
SCHEMBL13275271 0.85 HSD11B1 (0.34) HSD11B1
SCHEMBL3303677 0.85 HSD11B1 (0.34) HSD11B1
SCHEMBL282182 0.85 HSD11B1 (0.34) HSD11B1
SCHEMBL3303681 0.85 HSD11B1 (0.34) HSD11B1
SCHEMBL3346298 0.84 HSD11B1 (0.33) HSD11B1
SCHEMBL3349938 0.84 HSD11B1 (0.33) HSD11B1
SCHEMBL3346296 0.84 HSD11B1 (0.33) HSD11B1
SCHEMBL13275445 0.81 HSD11B1 (0.32) HSD11B1
SCHEMBL13275900 0.81 HSD11B1 (0.32) HSD11B1
SCHEMBL13275442 0.81 HSD11B1 (0.32) 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
US-8039503-B2 Lapachone compounds and methods of use thereof ARQULE, INC. (US) 2011-10-18 US disclosed