SCHEMBL16208015

SCHEMBL16208015

NC(=O)C12CC3C[C@H](C1)C(NC(=O)ON1CCN(c4ccc(-c5ccc(CO)cn5)cc4)c4ccccc41)[C@@H](C3)C2

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.48
HSD11B2 P80365 3/20 0.46

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
SCHEMBL974180 0.87 HSD11B1 (0.61) HSD11B1HSD11B2
SCHEMBL16208096 0.87 HSD11B1 (0.48) HSD11B1HSD11B2
SCHEMBL16208251 0.86 HSD11B1 (0.51) HSD11B1HSD11B2
SCHEMBL16207965 0.81 HSD11B1 (0.59) HSD11B1HSD11B2
SCHEMBL16208072 0.80 HSD11B1 (0.66) HSD11B1HSD11B2
SCHEMBL16207932 0.80 HSD11B1 (0.61) HSD11B1HSD11B2
SCHEMBL16207681 0.80 HSD11B1 (0.59) HSD11B1HSD11B2
SCHEMBL16208051 0.79 HSD11B1 (0.51) HSD11B1HSD11B2
SCHEMBL16208098 0.79 HSD11B1 (0.59) HSD11B1HSD11B2
SCHEMBL16208023 0.79 HSD11B1 (0.60) 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-2238126-B1 DERIVATIVES OF TETRAHYDROQUINOXALINE UREA, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI SA (FR) 2014-11-05 EP claimed