SCHEMBL16239473

SCHEMBL16239473

NC(=O)C12CC3C[C@H](C1)C(NC(=O)ON1CCN(c4ccc(N5CCC(N6CCC(F)(F)C6)CC5)cn4)c4ccccc41)[C@@H](C3)C2

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.56
HSD11B2 P80365 3/20 0.55

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
SCHEMBL16208097 0.91 HSD11B1 (0.61) HSD11B1HSD11B2
SCHEMBL16239603 0.91 HSD11B1 (0.58) HSD11B1HSD11B2
SCHEMBL16239405 0.91 HSD11B1 (0.58) HSD11B1HSD11B2
SCHEMBL16208031 0.91 HSD11B1 (0.60) HSD11B1HSD11B2
SCHEMBL16208099 0.89 HSD11B1 (0.64) HSD11B1HSD11B2
SCHEMBL16239448 0.88 HSD11B1 (0.58) HSD11B1HSD11B2
SCHEMBL16239582 0.87 HSD11B1 (0.60) HSD11B1HSD11B2
SCHEMBL16208100 0.86 HSD11B1 (0.61) HSD11B1HSD11B2
SCHEMBL16208213 0.86 HSD11B1 (0.62) HSD11B1HSD11B2
SCHEMBL16239874 0.86 HSD11B1 (0.62) 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-2459549-B1 TETRAHYDROQUINOXALINE UREA DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-11-19 EP claimed