SCHEMBL16208019

SCHEMBL16208019

NC(=O)C12CC3C[C@H](C1)C(NC(=O)ON1CCN(c4ccc(N5CCN(CC(F)(F)F)CC5)cn4)c4ccccc41)[C@@H](C3)C2

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.62
HSD11B2 P80365 2/20 0.62

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
SCHEMBL16207931 0.93 HSD11B1 (0.60) HSD11B1HSD11B2
SCHEMBL16208109 0.90 HSD11B1 (0.62) HSD11B1HSD11B2
SCHEMBL16208049 0.90 HSD11B1 (0.59) HSD11B1HSD11B2
SCHEMBL16208106 0.90 HSD11B1 (0.62) HSD11B1HSD11B2
SCHEMBL16208026 0.89 HSD11B1 (0.62) HSD11B1HSD11B2
SCHEMBL16208196 0.89 HSD11B1 (0.65) HSD11B1HSD11B2
SCHEMBL16208100 0.89 HSD11B1 (0.61) HSD11B1HSD11B2
SCHEMBL974135 0.89 HSD11B1 (0.78) HSD11B1HSD11B2
SCHEMBL16208202 0.88 HSD11B1 (0.79) HSD11B1HSD11B2
SCHEMBL16208097 0.88 HSD11B1 (0.61) 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