SCHEMBL1586793

SCHEMBL1586793

Cc1noc(-c2ccccc2C(=O)N2CC3CCN(c4ncc(Cl)c(C)n4)CC32)n1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 19/20 0.57
HCRTR2 O43614 19/20 0.57

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
SCHEMBL1586791 1.00 HCRTR1 (0.57) HCRTR1HCRTR2
SCHEMBL1586097 0.90 HCRTR1 (0.69) HCRTR1HCRTR2
SCHEMBL6908861 0.88 HCRTR1 (0.68) HCRTR1HCRTR2
SCHEMBL1586175 0.86 HCRTR1 (0.58) HCRTR1HCRTR2
SCHEMBL1586742 0.85 HCRTR1 (0.70) HCRTR1HCRTR2
SCHEMBL1586339 0.85 HCRTR1 (0.70) HCRTR1HCRTR2
SCHEMBL1586124 0.79 HCRTR1 (0.67) HCRTR1HCRTR2
SCHEMBL6907744 0.77 HCRTR1 (0.52) HCRTR1HCRTR2
SCHEMBL1586847 0.75 HCRTR1 (0.56) HCRTR1HCRTR2
SCHEMBL1586290 0.75 HCRTR1 (0.56) HCRTR1HCRTR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2491031-A1 FUSED HETEROCYCLIC COMPOUNDS AS OREXIN RECEPTOR MODULATORS Janssen Pharmaceutica N.V. (BE) 2012-08-29 EP disclosed
WO-2011050202-A1 FUSED HETEROCYCLIC COMPOUNDS AS OREXIN RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2011-04-28 WO disclosed