SCHEMBL1672272

SCHEMBL1672272

CCc1cccc(N2CC3CN(C(=O)c4ccc(OC)cc4OC)CC3C2)n1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 20/20 0.77
HCRTR1 O43613 16/20 0.77

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
SCHEMBL1670985 0.87 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL1671469 0.80 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL1671584 0.77 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL1672166 0.74 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL1671564 0.74 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL24013351 0.74 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL1671283 0.74 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL1672264 0.74 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL6923392 0.73 HCRTR2 (0.65) HCRTR2HCRTR1
SCHEMBL1672498 0.73 HCRTR2 (1.00) HCRTR2HCRTR1

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-2491038-A1 DISUBSTITUTED OCTAHY - DROPYRROLO [3,4-C]PYRROLES AS OREXIN RECEPTOR MODULATORS Janssen Pharmaceutica N.V. (BE) 2012-08-29 EP claimed
WO-2011050198-A1 DISUBSTITUTED OCTAHY - DROPYRROLO [3,4-C] PYRROLES AS OREXIN RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2011-04-28 WO claimed